SCHEMBL21623593

SCHEMBL21623593

CCc1c(C(F)(F)F)ccc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNJ11 Q14654 5/20 0.42
▸ ABCC9 O60706 4/20 0.42
▸ ABCC8 Q09428 4/20 0.42
▸ KCNJ8 Q15842 4/20 0.42
▸ NCEH1 Q6PIU2 1/20 0.42
▸ KDM4E B2RXH2 4/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ GAA P10253 2/20 0.41
▸ GLA P06280 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ TDP1 Q9NUW8 2/20 0.39

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
SCHEMBL6421434 0.81 HSD17B10 (0.41) KCNJ11ABCC9ABCC8KCNJ8KDM4E
SCHEMBL28534417 0.81 L3MBTL1 (0.52) KCNJ11ABCC9ABCC8KCNJ8KDM4E
SCHEMBL1538817 0.81 KCNJ11 (0.41) KCNJ11ABCC9ABCC8KCNJ8KDM4E
SCHEMBL28838140 0.80 L3MBTL1 (0.41) NCEH1KDM4EHSD17B10ALDH1A1MEN1
SCHEMBL24663928 0.75 NCEH1 (0.45) NCEH1KDM4EHSD17B10ALDH1A1MEN1
SCHEMBL22507522 0.75 HSD17B10 (0.54) NCEH1KDM4EHSD17B10ALDH1A1MEN1
SCHEMBL5249435 0.75 TSHR (0.54) KCNJ11ABCC9ABCC8KCNJ8KDM4E
SCHEMBL29678866 0.75 NCEH1 (0.45) NCEH1KDM4EHSD17B10ALDH1A1MEN1
SCHEMBL21872049 0.74 NCEH1 (0.52) NCEH1KDM4EMEN1KMT2AMAPT
SCHEMBL25164872 0.74 ALDH1A1 (0.35) KDM4EHSD17B10ALDH1A1POLBHPGD

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-2020013089-A1 COLORING COMPOSITION, FILM, COLOR FILTER, METHOD FOR MANUFACTURING COLOR FILTER, SOLID-STATE IMAGING ELEMENT, AND IMAGE DISPLAY DEVICE 富士フイルム株式会社 2020-01-16 — — WO disclosed
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