SCHEMBL17307077

SCHEMBL17307077

c1ccc(-c2cccc(-c3ccc4nc(-c5cc(-c6ccc(-c7ccccn7)cc6)cc(-c6cc7ccccc7c7ccccc67)c5)nc(-c5ccccc5)c4c3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ DHODH Q02127 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ METAP1 P53582 1/20 0.38
▸ CYP11B1 P15538 1/20 0.36
▸ HIF1A Q16665 2/20 0.36
▸ WHR1 P49842 1/20 0.36
▸ PIK3CA P42336 3/20 0.35
▸ PIK3CD O00329 2/20 0.35
▸ PIK3CG P48736 2/20 0.35
▸ PIK3CB P42338 1/20 0.35
▸ MTOR P42345 1/20 0.35
▸ MAPT P10636 5/20 0.34
▸ LMNA P02545 3/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ ALDH1A1 P00352 3/20 0.34

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
SCHEMBL17306466 0.94 MAPT (0.40) HSD17B10TSHRMAPK1DHODHMEN1
SCHEMBL17306771 0.93 MEN1 (0.39) HSD17B10TSHRMAPK1DHODHMEN1
SCHEMBL17306500 0.93 KMT2A (0.45) HSD17B10TSHRMAPK1DHODHMEN1
SCHEMBL17307083 0.90 DHODH (0.42) HSD17B10TSHRMAPK1DHODHMEN1
SCHEMBL17306596 0.89 MEN1 (0.41) HSD17B10TSHRMAPK1DHODHMEN1
SCHEMBL17306699 0.89 DHODH (0.43) HSD17B10TSHRMAPK1DHODHMEN1
SCHEMBL17307080 0.89 DHODH (0.43) HSD17B10TSHRMAPK1DHODHMEN1
SCHEMBL17306754 0.89 DHODH (0.43) HSD17B10TSHRMAPK1DHODHMEN1
SCHEMBL17306475 0.88 DHODH (0.43) HSD17B10TSHRMAPK1DHODHMEN1
SCHEMBL17306801 0.88 MAPT (0.41) HSD17B10TSHRMAPK1DHODHMEN1

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-2015182769-A1 QUINAZOLINE AND BENZOQUINAZOLINE COMPOUNDS AND PRODUCTION AND USE OF SAME 東ソー株式会社 2015-12-03 — — WO disclosed
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