SCHEMBL20647885

SCHEMBL20647885

OCCCCC#Cc1cc(I)ccc1I

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ HTR2C P28335 2/20 0.38
▸ HTR2B P41595 2/20 0.38
▸ PGK1 P00558 2/20 0.37
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ ATM Q13315 1/20 0.32
▸ RCE1 Q9Y256 1/20 0.32
▸ CHRNB4 P30926 1/20 0.30
▸ CHRNA3 P32297 1/20 0.30

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
SCHEMBL16946431 0.79 CYP3A4 (0.65) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL16946502 0.78 CYP3A4 (0.63) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL12185498 0.75 KDM4E (0.41) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL2797723 0.69 KDM4E (0.50) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL12185482 0.69 GABRP (0.47) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL18452361 0.68 KDM4E (0.53) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL9671501 0.66 KDM4E (0.52) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL18453785 0.66 KDM4E (0.52) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL2180477 0.66 CYP3A4 (0.67) KDM4EALDH1A1CYP1A2CYP3A4MAPT
SCHEMBL22614924 0.66 TPMT (0.50) KDM4EALDH1A1CYP1A2CYP3A4MAPT

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-10964902-B2 Film production method SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-03-30 — — US disclosed
US-20190019970-A1 FILM PRODUCTION METHOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-01-17 — — US disclosed
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