SCHEMBL2289465

SCHEMBL2289465

Brc1cc[c]c2cc3ccccc3cc12

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.35
NQO1 P15559 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HIF1A Q16665 1/20 0.32
CYP1B1 Q16678 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
NCEH1 Q6PIU2 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
SCHEMBL69340 0.78 CYP2A6 (0.41) CYP2A6NQO1ALDH1A1HIF1ACYP1B1
SCHEMBL9559831 0.76 CYP1A2 (0.40) NQO1ALDH1A1KDM4EGAA
SCHEMBL2255827 0.76 ALDH1A1 (0.40) NQO1ALDH1A1HIF1ACYP1B1HSD17B10
SCHEMBL1557069 0.74 CYP1A2 (0.39) CYP2A6NQO1ALDH1A1HIF1ACYP1B1
SCHEMBL629844 0.74 CYP1A2 (0.31)
SCHEMBL6152174 0.74 CYP1A2 (0.31)
SCHEMBL25231782 0.73 SLC9A1 (0.33) ALDH1A1HIF1ACYP1B1HSD17B10
SCHEMBL1168423 0.73 MEN1 (0.38) ALDH1A1HIF1AHSD17B10KDM4E
SCHEMBL30805630 0.73 CYP2A6 (0.48) CYP2A6NQO1ALDH1A1HIF1ACYP1B1
SCHEMBL1957000 0.73 CYP2A6 (0.48) CYP2A6NQO1ALDH1A1HIF1ACYP1B1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8709701-B2 Resist underlayer film forming composition for lithography, containing aromatic fused ring-containing resin NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-04-29 US disclosed
US-20110207331-A1 Resist underlayer film forming composition for lithography, containing aromatic fused ring-containing resin NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-08-25 US disclosed
US-20100022090-A1 RESIST UNDERLAYER FILM FORMING COMPOSITION FOR LITHOGRAPHY, CONTAINING AROMATIC FUSED RING-CONTAINING RESIN NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-01-28 US disclosed