SCHEMBL15073479

SCHEMBL15073479

c1ccc(-n2c3ccccc3c3cc4c(ccc5c6ccccc6n(-c6cccc(-c7cccnc7)c6)c45)cc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.43
▸ CYP11B1 P15538 4/20 0.39
▸ CYP19A1 P11511 3/20 0.39
▸ CYP11B2 P19099 3/20 0.39
▸ CYP17A1 P05093 1/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ CYP1A2 P05177 3/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ HSD17B1 P14061 1/20 0.38
▸ CYP2B6 P20813 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ HSD17B2 P37059 1/20 0.38
▸ FGFR1 P11362 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL15073934 1.00 MAPT (0.43) MAPTCYP11B1CYP19A1CYP11B2CYP17A1
SCHEMBL15073786 0.96 MAPT (0.43) MAPTCYP11B1CYP19A1CYP11B2CYP17A1
SCHEMBL15073473 0.96 MAPT (0.43) MAPTCYP11B1CYP19A1CYP11B2CYP17A1
SCHEMBL15073602 0.94 MAPT (0.39) MAPTCYP11B1CYP19A1CYP11B2CYP17A1
SCHEMBL15074022 0.94 MAPT (0.39) MAPTCYP11B1CYP19A1CYP11B2CYP17A1
SCHEMBL15073939 0.93 CYP11B1 (0.39) MAPTCYP11B1CYP19A1CYP11B2CYP17A1
SCHEMBL15073604 0.93 CYP11B1 (0.39) MAPTCYP11B1CYP19A1CYP11B2CYP17A1
SCHEMBL15073576 0.90 MAPT (0.47) MAPTCYP11B1CYP19A1CYP11B2CYP17A1
SCHEMBL15073900 0.89 MAPT (0.39) MAPTCYP11B1CYP19A1CYP11B2CYP17A1
SCHEMBL15073928 0.89 MAPT (0.39) MAPTCYP11B1CYP19A1CYP11B2CYP17A1

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
WO-2013094999-A2 ORGANIC COMPOUND, AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2013-06-27 — — WO disclosed
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