SCHEMBL5515919

SCHEMBL5515919

CNc1cc(F)cc2c(NC)cccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 1/20 0.42
▸ MAPT P10636 3/20 0.35
▸ TDP1 Q9NUW8 3/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ EGFR P00533 1/20 0.35
▸ PABPC1 P11940 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ KEAP1 Q14145 3/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ USP2 O75604 2/20 0.34
▸ NFE2L2 Q16236 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ RECQL P46063 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ POLB P06746 1/20 0.33

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
SCHEMBL5510298 0.83 IDO1 (0.52) IDO1MAPTTDP1L3MBTL1EGFR
SCHEMBL5513462 0.83 ALDH1A1 (0.41) IDO1TDP1KEAP1KDM4EALDH1A1
SCHEMBL8147899 0.80 IDO1 (0.58) IDO1MAPTTDP1L3MBTL1EGFR
SCHEMBL27937848 0.78 CYP1A2 (0.41) IDO1MAPTTDP1L3MBTL1RAB9A
SCHEMBL5511093 0.77 PARP1 (0.31) —
SCHEMBL27937813 0.77 IDO1 (0.47) IDO1MAPTTDP1L3MBTL1EGFR
SCHEMBL27919123 0.74 CYP1A2 (0.43) IDO1MAPTRAB9ASMN1; SMN2KEAP1
SCHEMBL5511146 0.74 IDO1 (0.41) IDO1MAPTTDP1L3MBTL1EGFR
SCHEMBL27937834 0.74 CYP1A2 (0.43) IDO1MAPTTDP1L3MBTL1EGFR
SCHEMBL5518761 0.72 IDO1 (0.35) IDO1KDM4EGLAGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7208559-B2 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2007-04-24 — — US disclosed
US-20060135712-A1 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2006-06-22 — — US disclosed
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