SCHEMBL2636719

SCHEMBL2636719

NC(=O)C(=O)N1CCC(Oc2cccc(Cl)c2)CC1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.56
OPRK1 P41145 2/20 0.51
CYP2C9 P11712 1/20 0.47
CYP2J2 P51589 1/20 0.47
SLC6A4 P31645 2/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
FPR2 P25090 1/20 0.46
PROKR1 Q8TCW9 1/20 0.46
HRH1 P35367 1/20 0.45
CCR3 P51677 1/20 0.45
HTR2C P28335 1/20 0.45
CNR1 P21554 1/20 0.45
KCNH2 Q12809 2/20 0.44
HRH3 Q9Y5N1 2/20 0.44
TRPA1 O75762 1/20 0.44

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
SCHEMBL1760979 0.88 EPHX2 (0.63) EPHX2OPRK1CYP2C9CYP2J2SLC6A4
SCHEMBL2932615 0.85 EPHX2 (0.63) EPHX2OPRK1CYP2C9CYP2J2SLC6A4
SCHEMBL2637470 0.84 EPHX2 (0.56) EPHX2OPRK1SLC6A4SLC6A2SLC6A3
SCHEMBL2636720 0.83 EPHX2 (0.55) EPHX2OPRK1CYP2C9CYP2J2SLC6A4
SCHEMBL22278187 0.83 EPHX2 (0.57) EPHX2OPRK1CYP2C9CYP2J2SLC6A4
SCHEMBL10608458 0.83 EPHX2 (0.57) EPHX2OPRK1CYP2C9CYP2J2SLC6A4
SCHEMBL12099943 0.82 OPRK1 (0.60) EPHX2OPRK1HRH1CCR3
SCHEMBL2636803 0.82 CYP11B2 (0.45) EPHX2OPRK1CYP2C9CYP2J2KCNH2
SCHEMBL22173976 0.82 EPHX2 (0.56) EPHX2OPRK1CYP2C9CYP2J2SLC6A4
SCHEMBL1010840 0.81 EPHX2 (0.59) EPHX2OPRK1SLC6A4SLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129376-B2 Piperidine derivatives as inhibitors of stearoyl-CoA desaturase AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2012-03-06 US claimed
US-20090239810-A1 NOVEL PIPERAZINE DERIVATIVES AS INHIBITORS OF STEAROYL-CoA DESATURASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2009-09-24 US claimed
US-10973810-B2 Methods for the treatment of neurological disorders YUMANITY THERAPEUTICS, INC. (US) 2021-04-13 US disclosed
EP-3566055-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS Yumanity Therapeutics, Inc. (US) 2019-11-13 EP disclosed
WO-2018129403-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS YUMANITY THERAPEUTICS (US) 2018-07-12 WO disclosed
US-20180193325-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS JANSSEN PHARMACEUTICA NV (BE) 2018-07-12 US disclosed
US-8129376-B2 Piperidine derivatives as inhibitors of stearoyl-CoA desaturase AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2012-03-06 US disclosed
WO-2009117676-A2 NOVEL PIPERIDINE DERIVATIVES AS INHIBITORS OF STEAROYL-COA DESATURASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2009-09-24 WO disclosed
US-20090239810-A1 NOVEL PIPERAZINE DERIVATIVES AS INHIBITORS OF STEAROYL-CoA DESATURASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2009-09-24 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 (3 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-10973810-B2 Methods for the treatment of neurological disorders NLN, CLN6, OTC EPHX2 1185/4885OPRK1 1470/4885CYP2C9 3233/4885
US-20090239810-A1 NOVEL PIPERAZINE DERIVATIVES AS INHIBITORS OF STEAROYL-CoA DESATURASE SCD, SCD5, FADS2 EPHX2 1023/4885OPRK1 3128/4885CYP2C9 2849/4885
US-20180193325-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS NLN, CLN6, OTC EPHX2 1185/4885OPRK1 1470/4885CYP2C9 3233/4885

“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.