SCHEMBL2135483

SCHEMBL2135483

CN(C)CCOC(=O)C1CC2C=CC1C2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.44
HPGD P15428 1/20 0.44
POLB P06746 3/20 0.44
KMT2A Q03164 2/20 0.44
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
APEX1 P27695 1/20 0.42
RECQL P46063 1/20 0.42
BLM P54132 1/20 0.42
ESR2 Q92731 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPK1 P28482 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRNB2 P17787 1/20 0.40

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
SCHEMBL5076849 1.00 ALDH1A1 (0.44) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL2140558 0.91 ALDH1A1 (0.43) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL2138421 0.90 ALDH1A1 (0.42) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL13897067 0.85 ALDH1A1 (0.53) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL14213298 0.85 ALDH1A1 (0.53) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL10388301 0.85 ALDH1A1 (0.53) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL2138385 0.85 ALDH1A1 (0.43) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL2136203 0.84 ALDH1A1 (0.42) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL12568208 0.83 ALDH1A1 (0.46) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL948162 0.83 ALDH1A1 (0.49) ALDH1A1HPGDPOLBKMT2ARAB9A

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1937734-B1 BIOCIDAL POLYMERS KE KELIT KUNSTSTOFFWERK GES M B H (AT) 2018-04-04 EP disclosed
US-8148484-B2 Poly(bicyclo[2.2.1]hept-5-ene-2-carboxylic acid 2-(tert-butylamino)ethyl ester); Poly(bicyclo[2.2.1]hept-5-ene-2-carboxylic acid 2-(dimethylamino)ethyl ester); used for disinfecting, sterilizing, and preventing biofouling in closed or open industrial-water systems and cooling-water systems KE KELIT KUNSTSTOFFWERK GESMBH (AT) 2012-04-03 US disclosed
US-20090221684-A1 Molecules for Gene Delivery and Gene Therapy, and Methods of Use Thereof TRUSTEES OF BOSTON UNIVERSITY (US) 2009-09-03 US disclosed
US-20090221684-A1 Molecules for Gene Delivery and Gene Therapy, and Methods of Use Thereof TRUSTEES OF BOSTON UNIVERSITY (US) 2009-09-03 US disclosed
US-20080251460-A1 Biocidal Polymers KE KELIT KUNSTSTOFFWERK GESMBH (AT) 2008-10-16 US disclosed
EP-1937734-A2 BIOCIDAL POLYMERS KE-KELIT Kunststoffwerk Gesellschaft m.b.H. (AT) 2008-07-02 EP disclosed
WO-2007073489-A2 MOLECULES FOR GENE DELIVERY AND GENE THERAPY, AND METHODS OF USE THEREOF TRUSTEES OF BOSTON UNIVERSITY (US) 2007-06-28 WO disclosed
WO-2007045634-A2 BIOCIDAL POLYMERS KE KELIT KUNSTSTOFFWERK GESMBH (AT) 2007-04-26 WO 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 (1 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-20090221684-A1 Molecules for Gene Delivery and Gene Therapy, and Methods of Use Thereof ANXA6, STING1, ADM2 ALDH1A1 2863/4885HPGD 3738/4885POLB 761/4885

“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.