SCHEMBL10629215

SCHEMBL10629215

C=C(C(=O)OCC)c1cn(Cc2ccccc2)c2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.63
▸ MAPK1 P28482 2/20 0.58
▸ ADORA1 P30542 2/20 0.56
▸ CNR1 P21554 1/20 0.56
▸ CNR2 P34972 1/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ F2RL3 Q96RI0 1/20 0.56
▸ NPSR1 Q6W5P4 4/20 0.55
▸ MEN1 O00255 3/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ HTT P42858 2/20 0.55
▸ LMNA P02545 1/20 0.54
▸ CYP1A2 P05177 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ CA12 O43570 1/20 0.53
▸ CA1 P00915 1/20 0.53

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
SCHEMBL28026387 0.87 NR4A2 (0.60) L3MBTL1CNR1ALDH1A1NPSR1KMT2A
SCHEMBL28026400 0.87 LMNA (0.50) L3MBTL1MAPK1ALDH1A1F2RL3LMNA
SCHEMBL15363131 0.85 ALDH1A1 (0.70) L3MBTL1MAPK1ADORA1CNR1CNR2
SCHEMBL8418110 0.83 CA12 (0.69) L3MBTL1MAPK1ADORA1CNR1CNR2
SCHEMBL28025825 0.81 NR4A2 (0.55) ALDH1A1NPSR1MEN1KMT2AHTT
SCHEMBL7163548 0.80 KDM1A (0.48) L3MBTL1ALDH1A1MEN1KMT2ALMNA
SCHEMBL10841087 0.80 TUBB4A (0.57) L3MBTL1MAPK1ADORA1CNR1CNR2
SCHEMBL15956289 0.79 LMNA (0.70) L3MBTL1CNR2ALDH1A1F2RL3LMNA
SCHEMBL2937566 0.78 LMNA (0.61) L3MBTL1CNR1CNR2LMNATP53
SCHEMBL9669606 0.78 L3MBTL1 (1.00) L3MBTL1MAPK1ADORA1CNR1CNR2

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
CN-104945303-A Preparation method of 3-alkenyl indole compound UNIV ZHEJIANG TECHNOLOGY 2015-09-30 — — CN disclosed
US-4758586-A Indolyl compounds and hyposensitivity use thereof USV PHARMACEUTICAL CORP. (US) 1988-07-19 — — US disclosed
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