SCHEMBL24450220

SCHEMBL24450220

CCCC(C)COc1ccc(C2=C3C(=O)NC(c4ccc(OC)cc4)=C3C(=O)N2)cc1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 15/20 0.39
ALDH1A1 P00352 2/20 0.39
PTGS2 P35354 1/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
GSK3B P49841 1/20 0.37
MAPK1 P28482 1/20 0.36

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
SCHEMBL19011934 0.84 FFAR1 (0.44) GPR88MAPT
SCHEMBL6935832 0.81 CYP2C9 (0.49) GPR88ALDH1A1KDM4EPOLBMAPT
SCHEMBL7004111 0.79 PTGS2 (0.54) PTGS2KDM4EMAPTGSK3BMAPK1
SCHEMBL16492016 0.76 CYP3A4 (0.39) ALDH1A1MAPTCYP2C9CYP2C19MAPK1
SCHEMBL23095277 0.75 MAPT (0.31) MAPT
SCHEMBL12424754 0.75 NQO1 (0.50) ALDH1A1KDM4EPOLBMAPTHPGD
SCHEMBL12425030 0.73 GSK3B (0.57) ALDH1A1PTGS2KDM4EMAPTGSK3B
SCHEMBL12424809 0.73 ACHE (0.52) ALDH1A1PTGS2KDM4EMAPTHPGD
SCHEMBL25636560 0.73 RARB (0.50) CYP2C9CYP2C19
SCHEMBL22954264 0.72 ESR2 (0.58) PTGS2GSK3BMAPK1

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-20220163884-A1 COMPOSITION, FILM, OPTICAL FILTER AND METHOD FOR MANUFACTURING THE SAME, SOLID-STATE IMAGING ELEMENT, INFRARED SENSOR, AND SENSOR MODULE FUJIFILM CORPORATION (JP) 2022-05-26 US disclosed