SCHEMBL28291736

SCHEMBL28291736

NC(=O)c1oc2ccccc2c(=O)c1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.62
CA2 P00918 4/20 0.62
KMT2A Q03164 4/20 0.50
HSD17B10 Q99714 3/20 0.50
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 3/20 0.50
CYP3A4 P08684 2/20 0.50
TP53 P04637 2/20 0.50
MEN1 O00255 2/20 0.50
LMNA P02545 2/20 0.50
PKM P14618 2/20 0.50
DDR2 Q16832 1/20 0.50
CA12 O43570 1/20 0.50
ABCB1 P08183 1/20 0.50
CALM1 P0DP23 1/20 0.50
AR P10275 1/20 0.50
ALOX15 P16050 1/20 0.50
MAPK1 P28482 1/20 0.50
CYP1B1 Q16678 1/20 0.50
CA9 Q16790 1/20 0.50

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
SCHEMBL29591307 0.87 CA1 (0.61) CA1CA2KMT2AHSD17B10KDM4E
SCHEMBL3417705 0.87 CA1 (0.61) CA1CA2KMT2AHSD17B10KDM4E
SCHEMBL27438850 0.84 CA1 (0.58) CA1CA2KMT2AHSD17B10KDM4E
SCHEMBL1133577 0.84 CA1 (0.58) CA1CA2KMT2AHSD17B10KDM4E
SCHEMBL7857929 0.84 CA1 (0.57) CA1CA2KMT2AHSD17B10KDM4E
SCHEMBL27716370 0.83 PTPN1 (0.66) CA1CA2KMT2AKDM4EALDH1A1
Water SCHEMBL27449135 0.83 CA1 (0.56) CA1CA2KMT2AHSD17B10KDM4E
SCHEMBL8154964 0.82 CA1 (0.55) CA1CA2KMT2AHSD17B10KDM4E
SCHEMBL22349646 0.81 KDM4E (0.58) CA1CA2KMT2AKDM4EALDH1A1
SCHEMBL29569597 0.80 CA1 (0.72) CA1CA2KMT2AHSD17B10KDM4E

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
EP-4225745-A1 ACETAMIDO-PHENYLBENZAMIDE DERIVATIVES AND METHODS OF USING THE SAME Athenex, Inc. (US) 2023-08-16 EP disclosed
WO-2022076662-A1 ACETAMIDO-PHENYLBENZAMIDE DERIVATIVES AND METHODS OF USING THE SAME ATHENEX, INC. (US) 2022-04-14 WO disclosed
CN-109641864-A ANTI-INFECTIVE AGENTS 邓迪大学 2019-04-16 CN disclosed