Sugi Predict

Sugi Predict / Compounds / SCHEMBL9922154

SCHEMBL9922154

SCHEMBL9922154

C1=Cc2c(c3ccccc3n2-c2cccc(-c3cccc(-c4cccc(-c5cccc(-c6cccc(-n7c8ccccc8c8cnccc87)c6)n5)n4)n3)c2)CN1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 4/20 0.32
▸ MAOB P27338 4/20 0.32
▸ ACHE P22303 1/20 0.32
▸ KARS1 Q15046 1/20 0.32
▸ ALOX5 P09917 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ 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
SCHEMBL16016292 1.00 MAOA (0.32) MAOAMAOBACHEKARS1ALOX5
SCHEMBL16016279 0.99 MAOA (0.32) MAOAMAOBACHEKARS1ALOX5
SCHEMBL13892741 0.95 KARS1 (0.30) KARS1
SCHEMBL9921799 0.91 MAOA (0.33) MAOAMAOBACHECYP2D6DDB1
SCHEMBL16016309 0.90 MAOA (0.33) MAOAMAOBACHECYP2D6DDB1
SCHEMBL4562425 0.89 KARS1 (0.30) KARS1
SCHEMBL13569550 0.88 HTR1A (0.32) —
SCHEMBL16016440 0.87 MAOA (0.31) MAOAMAOBACHECYP2D6
SCHEMBL16016472 0.86 MEN1 (0.31) —
SCHEMBL13070194 0.85 MAOA (0.32) MAOAMAOBACHECYP2D6DDB1

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
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