SCHEMBL2378435

SCHEMBL2378435

CN(C)C1(c2ccccc2)CCC(CC(=O)NCc2c[nH]c3ccccc23)CC1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 11/20 0.66
OPRM1 P35372 10/20 0.66
BCHE P06276 5/20 0.49
ACHE P22303 5/20 0.49
LMNA P02545 1/20 0.45
TACR1 P25103 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
Hydrochloric Acid SCHEMBL2378517 0.99 OPRL1 (0.65) OPRL1OPRM1BCHEACHELMNA
SCHEMBL302945 0.91 OPRL1 (0.55) OPRL1OPRM1
SCHEMBL2379029 0.90 OPRL1 (0.67) OPRL1OPRM1BCHEACHELMNA
Hydrochloric Acid SCHEMBL302553 0.89 OPRL1 (0.68) OPRL1OPRM1BCHEACHELMNA
SCHEMBL2379196 0.89 OPRL1 (0.62) OPRL1OPRM1BCHEACHE
Hydrochloric Acid SCHEMBL302176 0.88 OPRL1 (0.63) OPRL1OPRM1BCHEACHE
SCHEMBL303134 0.88 OPRL1 (0.61) OPRL1OPRM1BCHEACHE
SCHEMBL2381090 0.87 OPRL1 (0.60) OPRL1OPRM1BCHEACHE
SCHEMBL2378675 0.87 OPRL1 (0.60) OPRL1OPRM1BCHEACHE
Hydrochloric Acid SCHEMBL2380272 0.87 OPRL1 (0.62) OPRL1OPRM1BCHEACHE

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 8 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
EP-1751093-A1 SUBSTITUTED CYCLOHEXYLACETIC ACID DERIVATIVES Grünenthal GmbH (DE) 2007-02-14 EP disclosed
WO-2005110976-A1 SUBSTITUTED CYCLOHEXYLACETIC ACID DERIVATIVES Grünenthal GmbH (DE) 2005-11-24 WO 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 OPRL1 2478/4885OPRM1 3702/4885BCHE 806/4885

“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.