SCHEMBL5263994

SCHEMBL5263994

CC(NC(=O)c1cc2ccccc2o1)C(Cc1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.60
RAB9A P51151 2/20 0.60
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
ALDH1A1 P00352 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
LMNA P02545 1/20 0.56
THRB P10828 1/20 0.56
TAS1R3 Q7RTX0 3/20 0.54
TAS1R1 Q7RTX1 3/20 0.54
CNR1 P21554 9/20 0.53
CNR2 P34972 8/20 0.53
FDFT1 P37268 2/20 0.49
KDM4E B2RXH2 1/20 0.49
TP53 P04637 1/20 0.49
TSHR P16473 1/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL5373379 0.81 CNR1 (0.59) CNR1CNR2FDFT1
SCHEMBL5261127 0.81 CNR1 (0.49) CNR1CNR2FDFT1KDM4E
SCHEMBL5261412 0.80 CNR1 (0.55) CNR1CNR2FDFT1
SCHEMBL5262773 0.80 CNR1 (0.72) CNR1CNR2FDFT1
SCHEMBL5263996 0.79 CYP24A1 (0.59) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL5262269 0.78 CNR1 (0.63) RAB9AMEN1KMT2ACNR1CNR2
SCHEMBL6432925 0.78 CNR1 (0.55) ALDH1A1LMNACNR1CNR2FDFT1
SCHEMBL5259904 0.77 CNR1 (0.57) CNR1CNR2FDFT1
SCHEMBL5264037 0.77 CNR1 (0.65) NPC1RAB9ALMNACNR1CNR2
SCHEMBL5260009 0.76 FDFT1 (0.68) CNR1CNR2FDFT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1494997-A4 SUBSTITUTED ARYL AMIDES MERCK & CO INC (US) 2007-04-11 EP claimed
JP-2005527586-A 2005-09-15 JP claimed
US-20050154202-A1 Substituted aryl amides MERCK & CO., INC. 2005-07-14 US claimed
EP-1494997-A1 SUBSTITUTED ARYL AMIDES Merck & Co., Inc. (US) 2005-01-12 EP claimed
WO-2003087037-A1 SUBSTITUTED ARYL AMIDES MERCK & CO., INC. (US) 2003-10-23 WO claimed
EP-1494997-A4 SUBSTITUTED ARYL AMIDES MERCK & CO INC (US) 2007-04-11 EP disclosed
US-20050154202-A1 Substituted aryl amides MERCK & CO., INC. 2005-07-14 US disclosed
EP-1494997-A1 SUBSTITUTED ARYL AMIDES Merck & Co., Inc. (US) 2005-01-12 EP disclosed
WO-2004078261-A1 CANNABINOID RECEPTOR INVERSE AGONISTS AND NEUTRAL ANTAGONISTS AS THERAPEUTIC AGENTS FOR THE TREATMENT OF BONE DISORDERS THE UNIVERSITY COURT OF THE UNIVERSITY OF ABERDEEN (GB) 2004-09-16 WO disclosed
WO-2003087037-A1 SUBSTITUTED ARYL AMIDES MERCK & CO., INC. (US) 2003-10-23 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-20050154202-A1 Substituted aryl amides CNR1, CNR2, FAAH NPC1 288/4885RAB9A 1267/4885MEN1 359/4885

“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.