SCHEMBL3094281

SCHEMBL3094281

O=C(c1ccccc1)c1ccc(CN2CCNCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.67
ALDH1A1 P00352 4/20 0.60
USP2 O75604 1/20 0.60
TSHR P16473 1/20 0.60
HSD17B10 Q99714 1/20 0.60
HDAC1 Q13547 2/20 0.55
HDAC4 P56524 1/20 0.54
KCNH2 Q12809 1/20 0.54
CASP1 P29466 1/20 0.53
CASP4 P49662 1/20 0.53
CASP5 P51878 1/20 0.53
CXCR4 P61073 6/20 0.53
MEN1 O00255 1/20 0.53
CHRM2 P08172 1/20 0.53
CHRM1 P11229 1/20 0.53
ADRA2C P18825 1/20 0.53
CCR2 P41597 1/20 0.53
CXCL12 P48061 1/20 0.53
BLM P54132 1/20 0.53
KMT2A Q03164 1/20 0.53

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
SCHEMBL20876007 0.86 SIGMAR1 (0.69) SIGMAR1ALDH1A1TSHRHDAC1HDAC4
SCHEMBL3276896 0.85 CASP1 (0.64) ALDH1A1TSHRHSD17B10HDAC1HDAC4
SCHEMBL1160126 0.85 SIGMAR1 (0.62) SIGMAR1HDAC1HDAC4KCNH2CXCR4
Bicarbonate SCHEMBL21981463 0.85 SIGMAR1 (0.85) SIGMAR1ALDH1A1TSHRHDAC1HDAC4
SCHEMBL28206349 0.84 CASP1 (0.62) ALDH1A1TSHRHSD17B10HDAC1HDAC4
SCHEMBL13995932 0.84 SIGMAR1 (0.61) SIGMAR1HDAC1HDAC4KCNH2CXCR4
Hydrochloric Acid SCHEMBL28273325 0.84 SIGMAR1 (0.61) SIGMAR1HDAC1HDAC4KCNH2CXCR4
Hydrochloric Acid SCHEMBL10901935 0.84 SIGMAR1 (0.61) SIGMAR1HDAC1HDAC4KCNH2CXCR4
SCHEMBL3282966 0.84 CASP1 (0.62) ALDH1A1TSHRHSD17B10HDAC1HDAC4
Acetic Acid SCHEMBL7452259 0.82 SIGMAR1 (0.79) SIGMAR1ALDH1A1TSHRCXCR4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303544-A1 LMO2 PROTEIN INHIBITORS UNIV OF OXFORD (GB) 2023-09-28 US disclosed
US-20230303544-A1 LMO2 PROTEIN INHIBITORS UNIV OF OXFORD (GB) 2023-09-28 US disclosed
CN-110167626-B Low friction seal 苏尔莫迪克斯公司 2021-12-21 CN disclosed
CN-108348728-B Hemodialysis catheter sleeve 苏尔莫迪克斯公司 2021-07-09 CN disclosed
CN-107666872-B Insertable medical device system with plaque treatment portion and method of use thereof 舒尔默迪克斯公司 2021-05-18 CN disclosed
CN-106794283-B Article coating comprising oligomeric polyphenol layer and methods of biological use thereof 舒尔默迪克斯公司 2021-03-02 CN disclosed
CN-104185661-B The lubricity medical treatment device coating of low microgranule 苏尔莫迪克斯公司 2016-08-17 CN disclosed
EP-2838577-A1 HYDROPHILIC POLYMERIC COATINGS FOR MEDICAL ARTICLES WITH VISUALIZATION MOIETY SurModics, Inc. (US) 2015-02-25 EP disclosed
US-8722076-B2 Photochrome- or near IR dye-coupled polymeric matrices for medical articles SURMODICS, INC. (US) 2014-05-13 US disclosed
EP-2359943-B1 ULTRA-THIN PHOTO-POLYMERIC COATINGS AND USES THEREOF SURMODICS INC (US) 2014-01-22 EP disclosed
US-20100189877-A1 HYDROPHILIC POLYMERIC COATINGS FOR MEDICAL ARTICLES SURMODICS, INC. (US) 2010-07-29 US disclosed
US-20100096320-A1 Ultra-thin photo-polymer coatings and uses thereof SURMODICS, INC. 2010-04-22 US disclosed
EP-1893703-B1 HYDROPHILIC POLYMERIC COATINGS FOR MEDICAL ARTICLES SURMODICS INC (US) 2009-12-30 EP disclosed
EP-1945380-A2 ULTRA-THIN PHOTO-POLYMERIC COATINGS AND USES THEREOF SurModics, Inc. (US) 2008-07-23 EP disclosed
EP-1893703-A2 HYDROPHILIC POLYMERIC COATINGS FOR MEDICAL ARTICLES SurModics, Inc. (US) 2008-03-05 EP disclosed
EP-1858438-A2 COMPLIANT POLYMERIC COATINGS FOR INSERTABLE MEDICAL ARTICLES SurModics, Inc. (US) 2007-11-28 EP disclosed
WO-2007056338-A2 ULTRA-THIN PHOTO-POLYMERIC COATINGS AND USES THEREOF SURMODICS, INC. (US) 2007-05-18 WO disclosed
WO-2006130776-A2 HYDROPHILIC POLYMERIC COATINGS FOR MEDICAL ARTICLES SURMODICS, INC. (US) 2006-12-07 WO disclosed
WO-2006099470-A2 COMPLIANT POLYMERIC COATINGS FOR INSERTABLE MEDICAL ARTICLES SURMODICS, INC. (US) 2006-09-21 WO disclosed
US-20060210816-A1 Compliant polymeric coatings for insertable medical articles BANK OF MONTREAL, AS COLLATERAL AGENT 2006-09-21 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 (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-20230303544-A1 LMO2 PROTEIN INHIBITORS LMNB2, LMNB1, TPX2 SIGMAR1 1454/4885ALDH1A1 3524/4885USP2 3822/4885

“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.