SCHEMBL704586

SCHEMBL704586

Cc1[nH]c2ccccc2c1-c1cccc(F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 1/20 0.55
LMNA P02545 4/20 0.54
HPGD P15428 3/20 0.54
TDO2 P48775 1/20 0.49
TUBB4A P04350 2/20 0.48
TUBB P07437 2/20 0.48
TUBA3C P0DPH7 2/20 0.48
TUBA1B P68363 2/20 0.48
TUBA4A P68366 2/20 0.48
TUBB4B P68371 2/20 0.48
TUBB3 Q13509 2/20 0.48
TUBB2A Q13885 2/20 0.48
TUBB8 Q3ZCM7 2/20 0.48
TUBA3E Q6PEY2 2/20 0.48
TUBA1A Q71U36 2/20 0.48
TUBA1C Q9BQE3 2/20 0.48
TUBB6 Q9BUF5 2/20 0.48
TUBB2B Q9BVA1 2/20 0.48
TUBB1 Q9H4B7 2/20 0.48
DRD2 P14416 1/20 0.47

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
SCHEMBL28906448 0.82 DRD2 (0.45) IMPDH2LMNAHPGDTDO2TUBB4A
SCHEMBL27701196 0.81 IMPDH2 (0.65) IMPDH2LMNAHPGDCYP1A2CYP2C9
SCHEMBL694132 0.81 TNKS2 (0.41) IMPDH2LMNAHPGDTUBB4ATUBB
SCHEMBL17383846 0.81 IMPDH2 (0.73) IMPDH2LMNAHPGDHTR2AHTR2C
SCHEMBL27681973 0.79 PTGS2 (0.59) IMPDH2LMNAHPGDTUBB4ATUBB
SCHEMBL857878 0.76 PIM1 (0.55) TDO2MAPT
SCHEMBL19608343 0.75 ASH1L (0.57) IMPDH2CYP1A2CYP2C9MAPTGAA
SCHEMBL22899549 0.75 PADI4 (0.61) LMNAHPGDTUBB4ATUBBTUBA3C
SCHEMBL12125684 0.74 TAAR1 (0.48) LMNAHPGDTDO2CYP1A2ESR2
SCHEMBL16169793 0.74 IMPDH2 (0.69) IMPDH2LMNAHPGDHTR2AHTR2C

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-2421825-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP claimed
WO-2010124108-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO claimed