SCHEMBL17306804

SCHEMBL17306804

C1=CCNC(c2ccc(-c3cc(-c4ccc5c(ccc6ccccc65)c4)cc(-c4nc(-c5ccccc5)c5cc(-c6ccccc6)ccc5n4)c3)cc2)=C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ MAPT P10636 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ WHR1 P49842 1/20 0.33
▸ PIK3CD O00329 1/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ PIK3CB P42338 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ PIK3CG P48736 1/20 0.33
▸ HTR6 P50406 2/20 0.31
▸ HPGD P15428 2/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GAA P10253 1/20 0.31

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
SCHEMBL17306695 0.90 WHR1 (0.38) KMT2AMEN1ATMNPC1RAB9A
SCHEMBL17306413 0.87 MAPT (0.35) KMT2AMEN1ATMNPC1RAB9A
SCHEMBL17306878 0.86 MEN1 (0.37) KMT2AMEN1ATMWHR1HPGD
SCHEMBL17306799 0.84 KMT2A (0.47) KMT2AMEN1ATMNPC1RAB9A
SCHEMBL17306864 0.84 MEN1 (0.35) KMT2AMEN1ATMWHR1HPGD
SCHEMBL17306979 0.83 CYP1A2 (0.33) KMT2AMEN1ATMMAPT
SCHEMBL17306597 0.79 MEN1 (0.33) KMT2AMEN1ATMWHR1HPGD
SCHEMBL17306801 0.79 MAPT (0.41) KMT2AMEN1ATMNPC1RAB9A
SCHEMBL17306776 0.78 KDM4E (0.33) SMN1; SMN2LMNAMAPTKDM4EALDH1A1
SCHEMBL24473262 0.77 MEN1 (0.52) KMT2AMEN1ATMNPC1RAB9A

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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