SCHEMBL17665342

SCHEMBL17665342

NCc1cccc(C2c3ccccc3-n3cncc32)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 1/20 0.47
IDO1 P14902 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.33
PNMT P11086 1/20 0.31
ENPP2 Q13822 1/20 0.31
F10 P00742 1/20 0.31
PLG P00747 1/20 0.31
PRSS1 P07477 1/20 0.31
TPSAB1 Q15661 1/20 0.30
PRMT6 Q96LA8 1/20 0.30
ABCB1 P08183 1/20 0.30

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
SCHEMBL17665690 0.89 TDO2 (0.52) TDO2IDO1PRSS1ABCB1
SCHEMBL17665465 0.85 TDO2 (0.43) TDO2IDO1ABCB1
SCHEMBL17665680 0.78 TDO2 (0.43) TDO2IDO1LOXL2
SCHEMBL17665333 0.78 TDO2 (0.45) TDO2IDO1
SCHEMBL17665343 0.78 TDO2 (0.45) TDO2IDO1
SCHEMBL17665682 0.76 TDO2 (0.56) TDO2IDO1
SCHEMBL17665341 0.72 TDO2 (0.52) TDO2IDO1
SCHEMBL17665340 0.71 TDO2 (0.55) TDO2IDO1
SCHEMBL17665688 0.70 TDO2 (0.58) TDO2IDO1
SCHEMBL17651993 0.70 TDO2 (0.74) TDO2IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016051181-A1 4H-IMIDAZO[1,5-A]INDOLE DERIVATIVES AND THEIR USE AS INDOLEAMINE 2,3-DIOXYGENASE (IDO) AND/OR TRYPTOPHAN 2,3-DIOXYGENASE (TD02) MODULATORS REDX PHARMA PLC (GB) 2016-04-07 WO disclosed