SCHEMBL30100430

SCHEMBL30100430

COc1ccc(C)cc1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.59
ALDH1A1 P00352 8/20 0.56
KDM4E B2RXH2 4/20 0.56
HPGD P15428 3/20 0.56
ACHE P22303 1/20 0.56
LCK P06239 1/20 0.55
FYN P06241 1/20 0.55
MYC P01106 1/20 0.54
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA4 P22748 1/20 0.52
CA6 P23280 1/20 0.52
CA7 P43166 1/20 0.52
TPMT P51580 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
TDP1 Q9NUW8 2/20 0.52
MAPT P10636 2/20 0.52
HSD17B10 Q99714 2/20 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
SCHEMBL91954 1.00 CSNK2A1 (0.59) CSNK2A1ALDH1A1KDM4EHPGDACHE
SCHEMBL28837028 0.88 CSNK2A1 (0.59) CSNK2A1ALDH1A1KDM4EHPGDMYC
SCHEMBL365917 0.86 ALDH1A1 (0.65) CSNK2A1ALDH1A1KDM4EHPGDACHE
SCHEMBL9726812 0.85 ACHE (0.58) ALDH1A1HPGDACHEMAPTHSD17B10
SCHEMBL27376288 0.84 CSNK2A1 (0.55) CSNK2A1ALDH1A1KDM4EHPGDMYC
SCHEMBL11003356 0.84 CSNK2A1 (0.55) CSNK2A1ALDH1A1KDM4EHPGDMYC
SCHEMBL29678114 0.84 CSNK2A1 (0.55) CSNK2A1ALDH1A1KDM4EHPGDMYC
SCHEMBL20377181 0.84 CSNK2A1 (0.55) CSNK2A1ALDH1A1KDM4EHPGDMYC
SCHEMBL1210111 0.83 SRC (0.58) ALDH1A1KDM4EACHECA9MAPT
SCHEMBL30482833 0.83 SRC (0.58) ALDH1A1KDM4EACHECA9MAPT

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
EP-4093401-A1 SALICYLAMIDE DERIVATIVES AND RELATED METHODS OF MAKING The Board of Regents of the University of Texas System (US) 2022-11-30 EP disclosed