SCHEMBL28541012

SCHEMBL28541012

CC(=O)Nc1ccc(S(=O)(=O)CC#N)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.74
POLB P06746 2/20 0.61
ALDH1A1 P00352 2/20 0.61
MAPT P10636 1/20 0.61
KMT2A Q03164 1/20 0.61
KDM4E B2RXH2 1/20 0.59
CA1 P00915 3/20 0.59
CA2 P00918 3/20 0.59
CA12 O43570 2/20 0.59
CA9 Q16790 2/20 0.59
KDM1A O60341 1/20 0.57
MMP1 P03956 1/20 0.57
MMP2 P08253 1/20 0.57
MMP9 P14780 1/20 0.57
MMP8 P22894 1/20 0.57
MMP13 P45452 1/20 0.57
IDO1 P14902 1/20 0.56
PKM P14618 3/20 0.56
F2 P00734 1/20 0.55
PRSS1 P07477 1/20 0.55

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
SCHEMBL10942025 0.85 TP53 (1.00) TP53POLBALDH1A1MAPTKMT2A
SCHEMBL9497627 0.83 ALDH1A1 (0.61) TP53POLBALDH1A1MAPTKMT2A
SCHEMBL11883912 0.82 POLB (0.69) TP53POLBALDH1A1MAPTKMT2A
SCHEMBL14412438 0.80 POLB (0.72) TP53POLBALDH1A1MAPTKMT2A
SCHEMBL754757 0.79 POLB (0.65) TP53POLBALDH1A1MAPTKMT2A
SCHEMBL14363016 0.79 ALDH1A1 (0.70) TP53POLBALDH1A1MAPTKMT2A
SCHEMBL11380118 0.79 POLB (0.65) TP53POLBALDH1A1MAPTKMT2A
SCHEMBL24218721 0.79 ALDH1A1 (0.64) TP53POLBALDH1A1MAPTKMT2A
SCHEMBL6019491 0.79 POLB (0.75) TP53POLBALDH1A1KMT2AKDM4E
Water SCHEMBL8887158 0.78 CA1 (0.67) TP53POLBALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107024834-B Compound and coloring composition 住友化学株式会社 2021-11-23 CN disclosed
CN-107586469-B Pigment composition, coloring composition, and coloring curable composition 住友化学株式会社 2021-04-06 CN disclosed
CN-107586469-A Color compositions, coloured composition and cured composition for color 住友化学株式会社 2018-01-16 CN disclosed