SCHEMBL23552638

SCHEMBL23552638

CCCC1(CCC)c2cc(/C(=N\OC(C)=O)c3ccccc3C)ccc2-c2c1cc(C(=O)c1cccc3ccccc13)c1ccccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25B P30305 1/20 0.37
▸ CNR2 P34972 16/20 0.37
▸ CNR1 P21554 6/20 0.37
▸ CYP2C9 P11712 1/20 0.36
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ NR1I2 O75469 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ NR1H4 Q96RI1 1/20 0.32
▸ BCL2 P10415 1/20 0.32
▸ MCL1 Q07820 1/20 0.32
▸ BAD Q92934 1/20 0.32

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
SCHEMBL18123004 0.91 CNR2 (0.41) CDC25BCNR2CNR1CYP2C9NPC1
SCHEMBL23552879 0.89 MEN1 (0.30) MEN1HPGDKMT2A
SCHEMBL23552870 0.86 PKM (0.37) CYP2C9NPC1RAB9AALDH1A1CYP1A2
SCHEMBL23552858 0.86 — —
SCHEMBL23552648 0.85 NPC1 (0.32) NPC1RAB9AMAPTKMT2A
SCHEMBL17084343 0.82 NPC1 (0.36) CDC25BCNR2CNR1NPC1RAB9A
SCHEMBL18122999 0.82 CNR2 (0.41) CDC25BCNR2CNR1NPC1RAB9A
SCHEMBL23553033 0.81 CNR2 (0.35) CDC25BCNR2NPC1RAB9AMEN1
SCHEMBL23552876 0.80 KMT2A (0.33) NPC1RAB9AMEN1HPGDKMT2A
SCHEMBL18933437 0.80 NPC1 (0.34) NPC1RAB9AALDH1A1MAPTHPGD

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
US-20210191264-A1 NEGATIVE PHOTOSENSITIVE RESIN COMPOSITION, CURED FILM, AND ORGANIC EL DISPLAY AND MANUFACTURING METHOD THEREFOR TORAY INDUSTRIES, INC. (JP) 2021-06-24 — — US disclosed
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