SCHEMBL2623660

SCHEMBL2623660

COC(=O)CCC/C=C\c1cccc(C(=O)NC(C)CO)c1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.42
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
CNR2 P34972 3/20 0.40
CNR1 P21554 1/20 0.40
ATM Q13315 1/20 0.39
KCNK3 O14649 1/20 0.38
ALDH1A1 P00352 1/20 0.38
THRB P10828 1/20 0.38
BLM P54132 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL2763383 1.00 HPGD (0.42) HPGDCYP4F2CYP4A11CNR2CNR1
SCHEMBL2763382 1.00 HPGD (0.42) HPGDCYP4F2CYP4A11CNR2CNR1
SCHEMBL2763604 0.89 MAP4K4 (0.41) HPGDCNR2ATMKCNK3ALDH1A1
SCHEMBL14945497 0.89 ATM (0.40) HPGDCNR2ATMKCNK3ALDH1A1
SCHEMBL2763606 0.89 MAP4K4 (0.41) HPGDCNR2ATMKCNK3ALDH1A1
SCHEMBL2623659 0.89 MAP4K4 (0.41) HPGDCNR2ATMKCNK3ALDH1A1
SCHEMBL2764387 0.87 CNR2 (0.43) CNR2KCNK3ALDH1A1THRBBLM
SCHEMBL2764390 0.87 CNR2 (0.43) CNR2KCNK3ALDH1A1THRBBLM
SCHEMBL17049671 0.87 CNR2 (0.43) CNR2KCNK3ALDH1A1THRBBLM
SCHEMBL2632355 0.87 CNR2 (0.43) CNR2KCNK3ALDH1A1THRBBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180116983-A1 COMPOUNDS FOR TREATING DISORDERS ASSOCIATED WITH BK CHANNEL MODULATION CANBEX THERAPEUTICS LIMITED (GB) 2018-05-03 US disclosed
US-20180116983-A1 COMPOUNDS FOR TREATING DISORDERS ASSOCIATED WITH BK CHANNEL MODULATION CANBEX THERAPEUTICS LIMITED (GB) 2018-05-03 US disclosed
WO-2016128771-A1 COMPOUNDS FOR TREATING DISORDERS ASSOCIATED WITH BK CHANNEL MODULATION CANBEX THERAPEUTICS LIMITED (GB) 2016-08-18 WO disclosed
US-20160107984-A1 MODULATOR UNIVERSITY COLLEGE LONDON (GB) 2016-04-21 US disclosed
US-20160107984-A1 MODULATOR UNIVERSITY COLLEGE LONDON (GB) 2016-04-21 US disclosed
US-9120723-B2 Modulator CANBEX THERAPEUTICS LIMITED (GB) 2015-09-01 US disclosed
US-9120723-B2 Modulator CANBEX THERAPEUTICS LIMITED (GB) 2015-09-01 US disclosed
US-9024067-B2 Process for preparing carboxylic acid amides useful in the treatment of muscular disorders CANBEX THERAPEUTICS LIMITED (GB) 2015-05-05 US disclosed
US-9024067-B2 Process for preparing carboxylic acid amides useful in the treatment of muscular disorders CANBEX THERAPEUTICS LIMITED (GB) 2015-05-05 US disclosed
US-20130123356-A1 MODULATOR UNIVERSITY COLLEGE LONDON (GB) 2013-05-16 US disclosed
US-20120101301-A1 PROCESS FOR PREPARING CARBOXYLIC ACID AMIDES USEFUL IN THE TREATMENT OF MUSCULAR DISORDERS UCL BUSINESS PLC (GB) 2012-04-26 US disclosed
WO-2010116116-A1 PROCESS FOR PREPARING CARBOXYLIC ACID AMIDES USEFUL IN THE TREATMENT OF MUSCULAR DISORDERS UCL BUSINESS PLC (GB) 2010-10-14 WO disclosed
US-20100144876-A1 MODULATOR UNIVERSITY COLLEGE LONDON (GB) 2010-06-10 US disclosed
US-20100144876-A1 MODULATOR UNIVERSITY COLLEGE LONDON (GB) 2010-06-10 US disclosed
EP-2177503-A1 MODULATORS OF CANNABINOID RECEPTORS UCL Business PLC (GB) 2010-04-21 EP disclosed
US-7696382-B2 Modulator UNIVERSITY COLLEGE LONDON (GB) 2010-04-13 US disclosed
US-7696382-B2 Modulator UNIVERSITY COLLEGE LONDON (GB) 2010-04-13 US disclosed
EP-1745011-B1 MODULATORS OF CANNABINOID RECEPTORS UCL BUSINESS PLC (GB) 2009-09-30 EP disclosed
US-20080114062-A1 Modulator UNIVERSITY COLLEGE LONDON WOLFSON INSTITUTE FOR BIOMEDICAL RESEARCH (GB) 2008-05-15 US disclosed
US-20080114062-A1 Modulator UNIVERSITY COLLEGE LONDON WOLFSON INSTITUTE FOR BIOMEDICAL RESEARCH (GB) 2008-05-15 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 (6 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-20080114062-A1 Modulator CHRNA3, CHRM3, NR3C2 HPGD 2698/4885CYP4F2 380/4885CYP4A11 279/4885
US-20160107984-A1 MODULATOR CHRNA3, CHRNB3, CHRM3 HPGD 1896/4885CYP4F2 525/4885CYP4A11 435/4885
US-20130123356-A1 MODULATOR MRGPRX2, NR3C2, MC2R HPGD 750/4885CYP4F2 213/4885CYP4A11 22/4885
US-20120101301-A1 PROCESS FOR PREPARING CARBOXYLIC ACID AMIDES USEFUL IN THE TREATMENT OF MUSCULAR DISORDERS CPT1B, MUSK, C1R HPGD 2246/4885CYP4F2 523/4885CYP4A11 566/4885
US-20100144876-A1 MODULATOR CHRNA3, CHRM3, NR3C2 HPGD 2698/4885CYP4F2 380/4885CYP4A11 279/4885
US-20180116983-A1 COMPOUNDS FOR TREATING DISORDERS ASSOCIATED WITH BK CHANNEL MODULATION HCN4, KCNJ4, KCNQ4 HPGD 2385/4885CYP4F2 765/4885CYP4A11 235/4885

“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.