SCHEMBL1481994

SCHEMBL1481994

O=C(Cn1cc(-c2ccc(Cl)cc2Cl)nc1C=Cc1ccc(-c2ccc(O)cc2)cc1)NCc1ccc(F)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 10/20 0.54
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PLA2G7 Q13093 2/20 0.40
KCNA3 P22001 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
CES2 O00748 1/20 0.38
GRIN2B Q13224 1/20 0.38

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
SCHEMBL1481991 1.00 CNR1 (0.54) CNR1NPC1RAB9APLA2G7KCNA3
SCHEMBL1481859 0.90 CNR1 (0.56) CNR1RXFP1
SCHEMBL1481855 0.90 CNR1 (0.56) CNR1RXFP1
SCHEMBL1481827 0.89 CNR1 (0.44) CNR1NPC1RAB9ARXFP1
SCHEMBL1481826 0.89 CNR1 (0.44) CNR1NPC1RAB9ARXFP1
SCHEMBL1483140 0.87 CNR1 (0.47) CNR1NPC1RAB9APLA2G7RXFP1
SCHEMBL1481966 0.87 CNR1 (0.47) CNR1NPC1RAB9APLA2G7RXFP1
SCHEMBL1480553 0.86 CNR1 (0.46) CNR1PLA2G7RXFP1
SCHEMBL1480548 0.86 CNR1 (0.46) CNR1PLA2G7RXFP1
SCHEMBL1483135 0.83 SMN1; SMN2 (0.42) CNR1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents TRANSTECH PHARMA, INC. (US) 2011-03-31 US disclosed
EP-1594847-A2 SUBSTITUTED AZOLE DERIVATIVES AS THERAPEUTIC AGENTS Transtech Pharma, Inc. (US) 2005-11-16 EP disclosed
WO-2004071447-A9 SUBSTITUTED AZOLE DERIVATIVES AS THERAPEUTIC AGENTS TRANSTECH PHARMA INC (US) 2005-10-13 WO disclosed
US-20040192743-A1 Substituted azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. 2004-09-30 US disclosed
WO-2004071447-A2 SUBSTITUTED AZOLE DERIVATIVES AS THERAPEUTIC AGENTS TRANSTECH PHARMA INC. (US) 2004-08-26 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 (2 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-20040192743-A1 Substituted azole derivatives as therapeutic agents PTPRS, PTPRO, PTPRJ CNR1 3369/4885NPC1 3792/4885RAB9A 3266/4885
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents PTPRS, PTPRO, PTPRJ CNR1 3369/4885NPC1 3792/4885RAB9A 3266/4885

“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.