SCHEMBL24254816

SCHEMBL24254816

Fc1c(F)c(N(c2c(F)c(F)c(N(c3ccccc3)c3c(F)c(F)c(C(F)(F)F)c(F)c3F)c(F)c2F)c2c(F)c(F)c(C(F)(F)F)c(F)c2F)c(F)c(F)c1N(c1ccccc1)c1c(F)c(F)c(C(F)(F)F)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL24254706 0.92 ALDH1A1 (0.38) ALDH1A1TSHRKDM4ECYP1A2CYP3A4
SCHEMBL24254693 0.92 MEN1 (0.30) ALDH1A1MAPTL3MBTL1MEN1KMT2A
SCHEMBL24254817 0.84
SCHEMBL24254833 0.82 KIF11 (0.32)
SCHEMBL4301076 0.81 SMN1; SMN2 (0.34) TSHRMEN1KMT2ASMN1; SMN2
SCHEMBL25643779 0.80
SCHEMBL24254814 0.79 SMN1; SMN2 (0.33) TSHRMEN1KMT2ASMN1; SMN2
SCHEMBL24254665 0.79 SMN1; SMN2 (0.33) TSHRMEN1KMT2ASMN1; SMN2
SCHEMBL24254679 0.79 SMN1; SMN2 (0.33) TSHRMEN1KMT2ASMN1; SMN2
SCHEMBL24254692 0.78 MAPT (0.35) ALDH1A1TSHRKDM4ECYP3A4MAPT

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