SCHEMBL29930397

SCHEMBL29930397

CC(CC1(CC(C)C(N)=O)c2ccccc2-c2ccccc21)C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ APEX1 P27695 1/20 0.46
▸ KMT2A Q03164 1/20 0.40
▸ THRB P10828 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ KIF11 P52732 3/20 0.37
▸ FGFR1 P11362 1/20 0.36
▸ FGFR2 P21802 1/20 0.36
▸ FGFR4 P22455 1/20 0.36
▸ FGFR3 P22607 1/20 0.36
▸ PDK2 Q15119 6/20 0.35
▸ S100A4 P26447 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ITGA4 P13612 1/20 0.34
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HIF1A Q16665 1/20 0.33

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
SCHEMBL21219235 0.84 APEX1 (0.51) APEX1KMT2ATHRBTDP1KIF11
SCHEMBL29441927 0.84 APEX1 (0.51) APEX1KMT2ATHRBTDP1KIF11
SCHEMBL30314618 0.80 APEX1 (0.44) APEX1KMT2ATHRBTDP1FGFR1
SCHEMBL31576481 0.80 APEX1 (0.44) APEX1KMT2ATHRBTDP1PDK2
SCHEMBL15691740 0.78 APEX1 (0.49) APEX1KMT2ATHRBTDP1KIF11
SCHEMBL1232012 0.76 APEX1 (0.41) APEX1THRBTDP1PDK2ALDH1A1
SCHEMBL6060609 0.75 APEX1 (0.42) APEX1KMT2ATHRBTDP1PDK2
SCHEMBL15691751 0.74 APEX1 (0.41) APEX1KMT2ATHRBTDP1FGFR1
SCHEMBL15691548 0.74 APEX1 (0.45) APEX1KMT2ATHRBTDP1PDK2
SCHEMBL26017050 0.74 APEX1 (0.42) APEX1THRBTDP1KIF11PDK2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115103880-B Resin composition and fluidity improving method 大阪燃气化学有限公司 2023-05-16 — — CN disclosed
CN-115103880-A Resin composition and method for improving fluidity 大阪燃气化学有限公司 2022-09-23 — — CN disclosed
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