SCHEMBL7596615

SCHEMBL7596615

c1ccc2c(c1)ncn2-c1c[nH]c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 3/20 0.50
▸ MKNK2 Q9HBH9 3/20 0.50
▸ HTT P42858 2/20 0.49
▸ MAPK1 P28482 3/20 0.46
▸ POLB P06746 1/20 0.45
▸ FGFR1 P11362 1/20 0.44
▸ TP53 P04637 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ GABRP O00591 1/20 0.42
▸ GABRD O14764 1/20 0.42
▸ GABRA1 P14867 1/20 0.42
▸ GABRB1 P18505 1/20 0.42
▸ GABRG2 P18507 1/20 0.42
▸ GABRB3 P28472 1/20 0.42
▸ GABRA5 P31644 1/20 0.42
▸ GABRA3 P34903 1/20 0.42

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
SCHEMBL23308739 0.82 HTT (0.46) MKNK1MKNK2HTTMAPK1POLB
SCHEMBL2396567 0.76 TDO2 (0.42) MKNK1MKNK2MAPK1SMN1; SMN2GABRP
SCHEMBL3417306 0.75 HTT (0.73) MKNK1MKNK2HTTPOLBFGFR1
SCHEMBL5686122 0.73 GSK3B (0.74) GSK3B
SCHEMBL21163405 0.73 ADRB1 (0.39) MKNK1MKNK2HTTMAPK1POLB
SCHEMBL2186557 0.72 HCAR1 (0.56) MKNK1MKNK2HTTMAPK1POLB
SCHEMBL30955935 0.72 HCAR1 (0.56) MKNK1MKNK2HTTMAPK1POLB
SCHEMBL30524297 0.72 HTT (0.62) MKNK1MKNK2HTTMAPK1POLB
SCHEMBL5686043 0.72 SIRT2 (0.62) MKNK1MKNK2GSK3BMAPT
SCHEMBL311147 0.72 MAPK1 (0.52) MKNK1MKNK2HTTMAPK1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106220611-A The new preparation process of 2 (1H indole 3 base) 1H benzimidizole derivatives 青岛科技大学 2016-12-14 — — CN claimed
CN-106220611-A The new preparation process of 2 (1H indole 3 base) 1H benzimidizole derivatives 青岛科技大学 2016-12-14 — — CN disclosed
EP-0666858-B1 5-ARYLINDOLE DERIVATIVES AND THEIR USE AS SEROTONIN (5-HT 1) AGONISTS PFIZER (US) 2001-06-13 — — EP disclosed
EP-1094064-A1 5-arylindolederivatives and their use as serotonin(5-ht1)agonists PFIZER INC. (US) 2001-04-25 — — EP disclosed
US-5886008-A 5-arylindole derivatives PFIZER INC. (US) 1999-03-23 — — US disclosed
EP-0666858-A1 5-ARYLINDOLE DERIVATIVES AND THEIR USE AS SEROTONIN (5-HT 1?) AGONISTS PFIZER INC. (US) 1995-08-16 — — EP disclosed
WO-1994010171-A1 5-ARYLINDOLE DERIVATIVES AND THEIR USE AS SEROTONIN (5-HT1) AGONISTS PFIZER INC. (US) 1994-05-11 — — WO disclosed
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