SCHEMBL26036614

SCHEMBL26036614

CS(c1ccccc1)(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
TSHR P16473 1/20 0.44
MAPT P10636 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
PPARG P37231 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
MMP13 P45452 1/20 0.40
KIF11 P52732 1/20 0.39
TACR1 P25103 4/20 0.39
P2RX1 P51575 1/20 0.39
IDO1 P14902 1/20 0.39
TDO2 P48775 1/20 0.39
HTT P42858 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL26300710 0.86 CA1 (0.50) ALDH1A1TSHRMAPTCA1CA2
SCHEMBL25690704 0.83 ALDH1A1 (0.54) ALDH1A1TSHRKIF11MEN1KMT2A
SCHEMBL26428857 0.83 ALDH1A1 (0.54) ALDH1A1TSHRKIF11MEN1KMT2A
SCHEMBL26216559 0.78 RAPGEF4 (0.43) MAPTIDO1CES2PKMNPSR1
SCHEMBL3253436 0.75 HTR6 (0.47) ALDH1A1TSHRCA1CA2MMP1
SCHEMBL22175298 0.74 SLC6A4 (0.44) ALDH1A1TSHRMAPTKIF11MEN1
SCHEMBL25097675 0.72 GBA1 (0.38) L3MBTL1IDO1TDO2MEN1KMT2A
SCHEMBL24292548 0.72 GBA1 (0.38) L3MBTL1IDO1TDO2MEN1KMT2A
SCHEMBL25120144 0.71 CA1 (0.55) ALDH1A1TSHRL3MBTL1CA1CA2
SCHEMBL27764375 0.71 HTR6 (0.39) ALDH1A1TSHRCA1CA2MMP1

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-2023157455-A1 RADIATION-SENSITIVE COMPOSITION AND METHOD FOR FORMING RESIST PATTERN JSR株式会社 2023-08-24 WO disclosed