SCHEMBL2378658

SCHEMBL2378658

CN(C)C1(c2cccc(F)c2)CCC(=CC(=O)NCCCc2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 12/20 0.50
OPRL1 P41146 12/20 0.50
TAAR1 Q96RJ0 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 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
Hydrochloric Acid SCHEMBL2379845 0.99 OPRM1 (0.51) OPRM1OPRL1TAAR1NPC1RAB9A
SCHEMBL2379621 0.90 OPRM1 (0.60) OPRM1OPRL1TAAR1LMNA
SCHEMBL2378267 0.89 OPRM1 (0.53) OPRM1OPRL1TAAR1NPC1RAB9A
Hydrochloric Acid SCHEMBL302718 0.89 OPRL1 (0.61) OPRM1OPRL1TAAR1LMNA
Hydrochloric Acid SCHEMBL2379072 0.88 OPRM1 (0.53) OPRM1OPRL1TAAR1NPC1RAB9A
SCHEMBL2379697 0.87 OPRM1 (0.56) OPRM1OPRL1TAAR1LMNAHPGD
Hydrochloric Acid SCHEMBL302064 0.86 OPRL1 (0.57) OPRM1OPRL1TAAR1HPGD
SCHEMBL2378997 0.83 OPRL1 (0.51) OPRM1OPRL1TAAR1HPGD
SCHEMBL2379754 0.83 RAB9A (0.47) OPRM1OPRL1NPC1RAB9AGAA
Hydrochloric Acid SCHEMBL303067 0.82 OPRL1 (0.52) OPRM1OPRL1TAAR1HPGD

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-8017630-B2 Cyclohexylacetic acid compounds GRUENENTHAL GMBH (DE) 2011-09-13 US claimed
EP-1751093-B1 SUBSTITUTED CYCLOHEXYLACETIC ACID DERIVATIVES GRUENENTHAL GMBH (DE) 2010-10-06 EP claimed
US-20070129347-A1 Cyclohexylacetic acid compounds GRUENENTHAL GMBH (DE) 2007-06-07 US claimed
US-8017630-B2 Cyclohexylacetic acid compounds GRUENENTHAL GMBH (DE) 2011-09-13 US disclosed
EP-1751093-B1 SUBSTITUTED CYCLOHEXYLACETIC ACID DERIVATIVES GRUENENTHAL GMBH (DE) 2010-10-06 EP disclosed
US-20070129347-A1 Cyclohexylacetic acid compounds GRUENENTHAL GMBH (DE) 2007-06-07 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-20070129347-A1 Cyclohexylacetic acid compounds ACACA, HCAR2, PCCA OPRM1 3702/4885OPRL1 2478/4885TAAR1 1683/4885

“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.