SCHEMBL17306487

SCHEMBL17306487

c1ccc(-c2ccc(-c3nc(-c4cc(-c5ccc(-c6ccccn6)cc5)cc(-c5c6ccccc6cc6ccccc56)c4)nc4ccc(-c5ccccc5)cc34)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 1/20 0.40
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ ATM Q13315 1/20 0.39
▸ METAP1 P53582 1/20 0.39
▸ TSHR P16473 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ WHR1 P49842 1/20 0.37
▸ PIK3CD O00329 2/20 0.37
▸ PIK3CA P42336 2/20 0.37
▸ PIK3CG P48736 2/20 0.37
▸ PIK3CB P42338 1/20 0.37
▸ MTOR P42345 1/20 0.37
▸ LMNA P02545 4/20 0.36
▸ MAPT P10636 3/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 2/20 0.36

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
SCHEMBL17306469 0.92 LMNA (0.38) DHODHMEN1KMT2AATMMETAP1
SCHEMBL17306754 0.91 DHODH (0.43) DHODHMEN1KMT2AATMMETAP1
SCHEMBL17306699 0.91 DHODH (0.43) DHODHMEN1KMT2AATMMETAP1
SCHEMBL17307080 0.91 DHODH (0.43) DHODHMEN1KMT2AATMMETAP1
SCHEMBL17306475 0.90 DHODH (0.43) DHODHMEN1KMT2AATMMETAP1
SCHEMBL17306798 0.90 KMT2A (0.44) DHODHMEN1KMT2AATMMETAP1
SCHEMBL17307083 0.90 DHODH (0.42) DHODHMEN1KMT2AATMMETAP1
SCHEMBL17306862 0.89 MEN1 (0.40) DHODHMEN1KMT2AATMMETAP1
SCHEMBL17306478 0.89 WHR1 (0.45) DHODHMEN1KMT2AATMMETAP1
SCHEMBL17307074 0.89 WHR1 (0.45) DHODHMEN1KMT2AATMMETAP1

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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