SCHEMBL17229684

SCHEMBL17229684

BC(=O)N1CCC(c2ccc(F)cc2C)CC1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 10/20 0.54
KCNH2 Q12809 2/20 0.45
OPRM1 P35372 2/20 0.45
HSD11B1 P28845 1/20 0.42
TACR1 P25103 5/20 0.41
GRM5 P41594 1/20 0.40
ADAM10 O14672 1/20 0.40
NPC1 O15118 1/20 0.40
TRPV1 Q8NER1 1/20 0.39

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
SCHEMBL17229666 0.89 OPRL1 (0.43) OPRL1HSD11B1GRM5NPC1TRPV1
SCHEMBL17232805 0.82 SLC9A1 (0.54) KCNH2
SCHEMBL17234874 0.80 SCD5 (0.56) OPRL1HSD11B1GRM5
SCHEMBL19993076 0.79 OPRL1 (0.53) OPRL1KCNH2OPRM1
SCHEMBL17232806 0.78 RBP4 (0.53) KCNH2
SCHEMBL16951709 0.78 OPRL1 (0.59) OPRL1KCNH2OPRM1
SCHEMBL17229667 0.77 DRD4 (0.42) TRPV1
SCHEMBL17229668 0.77 RBP4 (0.37) OPRL1NPC1
SCHEMBL17229661 0.77 OPRL1 (0.42) OPRL1
SCHEMBL3436615 0.77 OPRL1 (0.50) OPRL1KCNH2OPRM1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11649240-B2 Substituted 4-phenylpiperidines, their preparation and use THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2023-05-16 US disclosed
US-20180030060-A1 SUBSTITUTED 4-PHENYLPIPERIDINES, THEIR PREPARATION AND USE THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2018-02-01 US disclosed
US-9777010-B2 Substituted 4-phenylpiperidines, their preparation and use THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2017-10-03 US disclosed
US-20160368925-A1 SUBSTITUTED 4-PHENYLPIPERIDINES, THEIR PREPARATION AND USE THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2016-12-22 US disclosed
US-9434727-B2 Substituted 4-phenylpiperidines, their preparation and use THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2016-09-06 US disclosed
US-20150315197-A1 SUBSTITUTED 4-PHENYLPIPERIDINES, THEIR PREPARATION AND USE THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2015-11-05 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 (4 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-20150315197-A1 SUBSTITUTED 4-PHENYLPIPERIDINES, THEIR PREPARATION AND USE HRH4, HRH3, HRH2 OPRL1 503/4885KCNH2 16/4885OPRM1 450/4885
US-20160368925-A1 SUBSTITUTED 4-PHENYLPIPERIDINES, THEIR PREPARATION AND USE HRH4, HRH3, HRH2 OPRL1 488/4885KCNH2 17/4885OPRM1 445/4885
US-20180030060-A1 SUBSTITUTED 4-PHENYLPIPERIDINES, THEIR PREPARATION AND USE HRH4, HRH3, HRH2 OPRL1 503/4885KCNH2 16/4885OPRM1 450/4885
US-11649240-B2 Substituted 4-phenylpiperidines, their preparation and use HRH4, HRH3, HRH2 OPRL1 503/4885KCNH2 16/4885OPRM1 450/4885

“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.