SCHEMBL24254641

SCHEMBL24254641

Fc1c(F)c(F)c(N(c2ccccc2)c2ccccc2-c2ccccc2N(c2ccc(C(F)(F)F)cc2)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
KIF11 P52732 1/20 0.38
CYP3A4 P08684 4/20 0.34
TRPV6 Q9H1D0 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
TACR1 P25103 2/20 0.32
BACE1 P56817 2/20 0.31
ALOX5 P09917 1/20 0.31
PTGS2 P35354 1/20 0.31
GPR3 P46089 1/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL24254817 0.84
SCHEMBL20386605 0.76 ALDH1A1 (0.59) ALDH1A1TSHRKIF11CYP3A4TRPV6
SCHEMBL16710466 0.76 ALDH1A1 (0.59) ALDH1A1TSHRKIF11CYP3A4TRPV6
SCHEMBL9231291 0.76 ALDH1A1 (0.59) ALDH1A1TSHRKIF11CYP3A4TRPV6
SCHEMBL16710464 0.76 ALDH1A1 (0.59) ALDH1A1TSHRKIF11CYP3A4TRPV6
SCHEMBL24254695 0.76 MEN1 (0.31)
SCHEMBL24254766 0.73 MGLL (0.38) ALDH1A1TSHRKIF11CYP3A4TRPV6
SCHEMBL27256051 0.72 KIF11 (0.53) ALDH1A1TSHRKIF11CYP3A4TRPV6
SCHEMBL16215950 0.72 ALDH1A1 (0.42) ALDH1A1TSHRCYP3A4KDM4ECYP1A2
SCHEMBL24254706 0.72 ALDH1A1 (0.38) ALDH1A1TSHRCYP3A4KDM4ECYP1A2

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
WO-2022034907-A1 METAL PATTERNING MATERIAL, AMINE COMPOUND, ELECTRONIC DEVICE, AND METHOD FOR FORMING METAL PATTERN 東ソー株式会社 2022-02-17 WO disclosed