SCHEMBL179665

SCHEMBL179665

CNCCSSCCOC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
CHRM5 P08912 2/20 0.38
CHRM1 P11229 2/20 0.38
CHRM3 P20309 2/20 0.38
TSHR P16473 2/20 0.38
PGR P06401 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
HTR1A P08908 1/20 0.38
CHRNB2 P17787 1/20 0.38
TBXA2R P21731 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA7 P36544 1/20 0.38
CHRNA4 P43681 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CHRNA10 Q9GZZ6 1/20 0.38
CHRNA9 Q9UGM1 1/20 0.38
GALR3 O60755 2/20 0.36
GAA P10253 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23133545 0.87 ALDH1A1 (0.38) ALDH1A1CHRM5CHRM1CHRM3TSHR
SCHEMBL17253261 0.85 ALDH1A1 (0.50) ALDH1A1CHRM5CHRM1CHRM3TSHR
SCHEMBL14712717 0.84 LMNA (0.34) TSHRLMNA
SCHEMBL423666 0.82 LMNA (0.33) LMNA
SCHEMBL28708551 0.82 LMNA (0.39) CHRM5CHRM1CHRM3TSHRCHRM2
SCHEMBL12608885 0.81 ADRB2 (0.36) LMNA
SCHEMBL454478 0.79 ALDH1A1 (0.35) ALDH1A1CHRM5CHRM1CHRM3TSHR
SCHEMBL1892585 0.78
SCHEMBL1040128 0.77 ALDH1A1 (0.43) ALDH1A1CHRM5CHRM1CHRM3TSHR
SCHEMBL16327847 0.77 ALDH1A1 (0.48) ALDH1A1CHRM5CHRM1CHRM3TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3566719-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF AUTOIMMUNE AND OTHER DISEASES Cerulean Pharma Inc. (US) 2019-11-13 EP disclosed
US-20170362346-A1 METHODS AND SYSTEMS FOR POLYMER PRECIPITATION AND GENERATION OF PARTICLES CERULEAN PHARMA INC (US) 2017-12-21 US disclosed
US-9610360-B2 Polymer drug conjugates with tether groups for controlled drug delivery CERULIEAN PHARMA INC. (US) 2017-04-04 US disclosed
US-9598503-B2 Methods and systems for polymer precipitation and generation of particles CERULEAN PHARMA INC. (US) 2017-03-21 US disclosed
US-20160166567-A1 TREATMENT OF CANCER CERULEAN PHARMA INC. (US) 2016-06-16 US disclosed
US-20160101185-A1 TREATMENT OF CANCER CERULEAN PHARMA INC. (US) 2016-04-14 US disclosed
US-20160082111-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CERULEAN PHARMA INC. (US) 2016-03-24 US disclosed
US-20160058874-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CERULEAN PHARMA INC. (US) 2016-03-03 US disclosed
US-20160058873-A1 Cyclodextrin-Based Polymers for Therapeutic Delivery CERULEAN PHARMA INC (US) 2016-03-03 US disclosed
US-20160058875-A1 TREATMENT OF CANCER CERULEAN PHARMA INC. (US) 2016-03-03 US disclosed
US-20130202659-A1 POLYMER-AGENT CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS OF USE CERULEAN PHARMA INC. (US) 2013-08-08 US disclosed
US-20130196946-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CERULEAN PHARMA INC. (US) 2013-08-01 US disclosed
US-8497365-B2 Cyclodextrin-based polymers for therapeutics delivery INSERT THERAPEUTICS, INC. 2013-07-30 US disclosed
US-20130164282-A1 TREATMENT OF CANCER CERULEAN PHARMA INC. (US) 2013-06-27 US disclosed
US-20130096293-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTICS DELIVERY CERULEAN PHARMA INC. (US) 2013-04-18 US disclosed
US-20130029909-A1 TREATMENT OF CANCER CERULEAN PHARMA INC. 2013-01-31 US disclosed
US-20120302505-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CERULEAN PHARMA INC. 2012-11-29 US disclosed
US-20120065161-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CERULEAN PHARMA INC. (US) 2012-03-15 US disclosed
US-20120058971-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CERULEAN PHARMA INC. (US) 2012-03-08 US disclosed
US-20120052097-A1 THERAPEUTIC PEPTIDE-POLYMER CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC. (US) 2012-03-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (15 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120058971-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY SDCBP, DDOST, DSC1 ALDH1A1 3011/4885CHRM5 4196/4885CHRM1 4598/4885
US-20130202659-A1 POLYMER-AGENT CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS OF USE LPXN, POLI, BRCA1 ALDH1A1 1992/4885CHRM5 4316/4885CHRM1 4620/4885
US-20160082111-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY SDCBP, DDOST, DSC1 ALDH1A1 3011/4885CHRM5 4196/4885CHRM1 4598/4885
US-20160058873-A1 Cyclodextrin-Based Polymers for Therapeutic Delivery IAPP, PRCP, DDOST ALDH1A1 4479/4885CHRM5 3181/4885CHRM1 3691/4885
US-20130096293-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTICS DELIVERY DDOST, STT3B, STT3A ALDH1A1 2326/4885CHRM5 4178/4885CHRM1 4551/4885
US-20160101185-A1 TREATMENT OF CANCER TOP1, TOP2A, TOP2B ALDH1A1 1266/4885CHRM5 4032/4885CHRM1 4197/4885
US-20130196946-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY SDCBP, DDOST, DSC1 ALDH1A1 3011/4885CHRM5 4196/4885CHRM1 4598/4885
US-20130029909-A1 TREATMENT OF CANCER TOP1, TOP2A, TOP2B ALDH1A1 1266/4885CHRM5 4032/4885CHRM1 4197/4885
US-20120052097-A1 THERAPEUTIC PEPTIDE-POLYMER CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS IAPP, PSAP, LNPEP ALDH1A1 4482/4885CHRM5 4644/4885CHRM1 4797/4885
US-20120065161-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY DDOST, SDCBP, STT3B ALDH1A1 2405/4885CHRM5 4130/4885CHRM1 4492/4885
US-20130164282-A1 TREATMENT OF CANCER TOP1, TOP2A, TOP2B ALDH1A1 1266/4885CHRM5 4032/4885CHRM1 4197/4885
US-20120302505-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY IAPP, PRCP, DDOST ALDH1A1 4479/4885CHRM5 3181/4885CHRM1 3691/4885
US-20160166567-A1 TREATMENT OF CANCER TOP1, TOP2A, TOP2B ALDH1A1 1266/4885CHRM5 4032/4885CHRM1 4197/4885
US-20160058875-A1 TREATMENT OF CANCER TOP1, TOP2A, TOP2B ALDH1A1 1266/4885CHRM5 4032/4885CHRM1 4197/4885
US-20160058874-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY CDR2, DDOST, GALC ALDH1A1 2989/4885CHRM5 3146/4885CHRM1 3573/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.