SCHEMBL697424

SCHEMBL697424

O=C(c1ccc(Cl)nc1)c1c[nH]c2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.59
TP53 P04637 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
HAT1 O14929 2/20 0.50
EP300 Q09472 2/20 0.50
ALDH1A1 P00352 2/20 0.49
PBRM1 Q86U86 1/20 0.49
ATM Q13315 1/20 0.49
PIM1 P11309 1/20 0.48
IGF1R P08069 1/20 0.47
MET P08581 1/20 0.47
KMT2A Q03164 2/20 0.47
AHR P35869 2/20 0.46
CTNNB1 P35222 1/20 0.46
WNT3A P56704 1/20 0.46
MAPK1 P28482 1/20 0.46
NR4A2 P43354 1/20 0.46
CREBBP Q92793 1/20 0.46
NAPRT Q6XQN6 1/20 0.45

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
SCHEMBL27216649 0.83 GPR84 (0.59) GPR84TP53SMN1; SMN2NPSR1ALDH1A1
SCHEMBL6840316 0.83 NAPRT (0.53) GPR84TP53SMN1; SMN2NPSR1HAT1
SCHEMBL699561 0.82 NAPRT (0.41) GPR84TP53SMN1; SMN2NPSR1HAT1
SCHEMBL858716 0.81 MAP2K1 (0.53) GPR84SMN1; SMN2KMT2ANAPRT
SCHEMBL6705760 0.81 GPR84 (0.69) GPR84TP53SMN1; SMN2NPSR1ALDH1A1
SCHEMBL21448966 0.78 MAPT (0.61) GPR84TP53SMN1; SMN2NPSR1ALDH1A1
SCHEMBL700094 0.77 GPR84 (0.63) GPR84TP53SMN1; SMN2NPSR1ALDH1A1
SCHEMBL3279652 0.77 GPR84 (0.79) GPR84TP53SMN1; SMN2NPSR1ALDH1A1
SCHEMBL29988308 0.77 GPR84 (0.79) GPR84TP53SMN1; SMN2NPSR1ALDH1A1
SCHEMBL2028344 0.77 GPR84 (1.00) GPR84TP53SMN1; SMN2NPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2421823-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP disclosed
WO-2010124086-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO disclosed