SCHEMBL27345183

SCHEMBL27345183

Nc1ccc(-c2ccccc2)c(-c2ccccc2Nc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.51
▸ GAA P10253 6/20 0.51
▸ TDP1 Q9NUW8 5/20 0.51
▸ HTT P42858 4/20 0.51
▸ ALOX15 P16050 3/20 0.51
▸ MAPT P10636 8/20 0.46
▸ KDM4E B2RXH2 6/20 0.46
▸ MEN1 O00255 5/20 0.46
▸ KMT2A Q03164 5/20 0.46
▸ LMNA P02545 4/20 0.46
▸ CYP1A2 P05177 3/20 0.46
▸ CYP2C9 P11712 3/20 0.46
▸ CYP2C19 P33261 2/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ GFER P55789 1/20 0.44
▸ L3MBTL1 Q9Y468 3/20 0.44
▸ NSD2 O96028 2/20 0.44
▸ POLB P06746 2/20 0.44
▸ RECQL P46063 2/20 0.44
▸ APEX1 P27695 1/20 0.44

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
SCHEMBL24680534 0.84 MAPT (0.53) ALDH1A1GAATDP1HTTALOX15
SCHEMBL29973088 0.83 GAA (0.58) ALDH1A1GAATDP1HTTALOX15
SCHEMBL16720876 0.82 MAPT (0.50) ALDH1A1GAATDP1ALOX15MAPT
SCHEMBL27887780 0.81 ALDH1A1 (0.61) ALDH1A1GAATDP1HTTALOX15
SCHEMBL14053875 0.81 MAPT (0.60) ALDH1A1GAATDP1HTTALOX15
SCHEMBL2440084 0.81 ALDH1A1 (0.63) ALDH1A1GAATDP1HTTALOX15
SCHEMBL16820312 0.80 PTPRC (0.63) ALDH1A1TDP1HTTMAPTKDM4E
SCHEMBL27024567 0.80 GAA (0.61) ALDH1A1GAATDP1HTTALOX15
Benzene SCHEMBL28417037 0.78 FABP4 (0.55) ALDH1A1GAATDP1ALOX15MAPT
SCHEMBL588648 0.78 FABP4 (0.55) ALDH1A1GAATDP1ALOX15MAPT

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-1043766-C Indole derivative and preparation and pharmaceutical using of same TORAY INDUSTRIES (JP) 1999-06-23 — — CN disclosed
CN-1092425-A Indole derivatives, its manufacture method and medicinal use thereof TORAY INDUSTRIES (JP) 1994-09-21 — — CN disclosed
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