SCHEMBL9921799

SCHEMBL9921799

C1=Cc2c(c3ccccc3n2-c2ccc(-c3cccc(-c4cccc(-c5cccc(-c6ccc(-n7c8ccccc8c8cnccc87)cc6)n5)n4)n3)cc2)CN1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.33
MAOB P27338 4/20 0.33
ACHE P22303 1/20 0.33
CYP2D6 P10635 1/20 0.32
DDB1 Q16531 1/20 0.31
CRBN Q96SW2 1/20 0.31

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
SCHEMBL16016309 0.99 MAOA (0.33) MAOAMAOBACHECYP2D6DDB1
SCHEMBL19022075 0.91 MAOA (0.37) MAOAMAOBACHECYP2D6DDB1
SCHEMBL9922154 0.91 MAOA (0.32) MAOAMAOBACHECYP2D6DDB1
SCHEMBL16016292 0.91 MAOA (0.32) MAOAMAOBACHECYP2D6DDB1
SCHEMBL19258179 0.90 MAOA (0.31) MAOAMAOBACHECYP2D6DDB1
SCHEMBL13569563 0.90 MAOA (0.31) MAOAMAOBACHECYP2D6DDB1
SCHEMBL16016279 0.90 MAOA (0.32) MAOAMAOBACHECYP2D6DDB1
SCHEMBL9270301 0.89 CDK4 (0.32)
SCHEMBL13569478 0.88
SCHEMBL13569566 0.87 CYP19A1 (0.41) DDB1CRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2463288-B1 Compound having substituted pyridyl group and pyridoindole ring structure linked through phenylene group, and organic electroluminescent device HODOGAYA CHEMICAL CO LTD (JP) 2014-09-10 EP disclosed
EP-2463288-A1 Compound having substituted pyridyl group and pyridoindole ring structure linked through phenylene group, and organic electroluminescent device Hodogaya Chemical Co., Ltd. (JP) 2012-06-13 EP disclosed
EP-2241568-A1 COMPOUND HAVING SUBSTITUTED PYRIDYL GROUP AND PYRIDOINDOLE RING STRUCTURE LINKED THROUGH PHENYLENE GROUP, AND ORGANIC ELECTROLUMINESCENT DEVICE Hodogaya Chemical Co., Ltd. (JP) 2010-10-20 EP disclosed