SCHEMBL3267318

SCHEMBL3267318

O=C1c2ccccc2C(=O)N1Cc1nc(-c2ccc(Cl)cc2Cl)n(-c2ccc(Cl)cc2)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.45
CNR2 P34972 3/20 0.44
ALDH1A1 P00352 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ADRA1D P25100 1/20 0.39
ADRA1A P35348 1/20 0.39
ADRA1B P35368 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C19 P33261 1/20 0.38
HTT P42858 1/20 0.38
RECQL P46063 1/20 0.38
GRM5 P41594 2/20 0.38
TYR P14679 1/20 0.37

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
SCHEMBL3267515 0.79 CNR1 (0.49) CNR1CNR2KMT2A
SCHEMBL3268899 0.78 CNR1 (0.48) CNR1CNR2KMT2ACYP3A4
SCHEMBL3267028 0.78 CNR1 (0.51) CNR1CNR2KMT2A
SCHEMBL3366114 0.69 CNR1 (0.65) CNR1CNR2KMT2AHTT
SCHEMBL3367684 0.69 CNR1 (0.65) CNR1CNR2KMT2AHTT
SCHEMBL4480277 0.69 ALDH1A1 (0.51) CNR1CNR2ALDH1A1RXFP1MAPT
SCHEMBL11081773 0.69 MAPT (0.58) ALDH1A1MAPK1MEN1KMT2AMAPT
SCHEMBL3814385 0.68 DPP4 (0.40) ALDH1A1RXFP1CYP1A2CYP3A4CYP2D6
SCHEMBL18668950 0.66 CES2 (0.67) ALDH1A1ADRA1DADRA1AADRA1B
SCHEMBL3729290 0.66 GRM5 (0.54) ALDH1A1MEN1KMT2AHTTGRM5

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-7781471-B2 Diaryl triazolmethylamine derivatives, preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2010-08-24 US disclosed
EP-1966167-B1 DIARYLTRIAZOLMETHYLAMINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2010-06-16 EP disclosed
US-20080293794-A1 DIARYLTRIAZOLMETHYLAMINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2008-11-27 US disclosed
EP-1966167-A1 DIARYLTRIAZOLMETHYLAMINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF sanofi-aventis (FR) 2008-09-10 EP disclosed
WO-2007068814-A1 DIARYLTRIAZOLMETHYLAMINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-06-21 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-20080293794-A1 DIARYLTRIAZOLMETHYLAMINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF LTB4R2, LTB4R, CYSLTR1 CNR1 31/4885CNR2 15/4885ALDH1A1 565/4885

“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.