SCHEMBL20726432

SCHEMBL20726432

C/C(O)=C1\C(=O)Nc2cc(O)c(-c3ccc(N4CCC(O)C4)cc3)cc21

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.36
CDK2 P24941 1/20 0.36
LOXL2 Q9Y4K0 1/20 0.35
SYK P43405 4/20 0.35
CFTR P13569 1/20 0.35
PRKAG1 P54619 1/20 0.35
PRKAA1 Q13131 1/20 0.35
PRKAB1 Q9Y478 1/20 0.35
RORC P51449 3/20 0.35
USP8 P40818 1/20 0.35
ABL1 P00519 4/20 0.35
PHGDH O43175 1/20 0.34
AR P10275 1/20 0.34

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
SCHEMBL20726500 1.00 CDK1 (0.36) CDK1CDK2LOXL2SYKCFTR
SCHEMBL20726458 0.90 PRKAG1 (0.40) SYKPRKAG1PRKAA1PRKAB1RORC
SCHEMBL20726502 0.85 BRD4 (0.39) USP8
SCHEMBL20726357 0.84 BRD4 (0.40) USP8
SCHEMBL20726517 0.83 PRKAG1 (0.39) CFTRPRKAG1PRKAA1PRKAB1USP8
SCHEMBL20726412 0.83 PRKDC (0.43) CFTRPRKAG1PRKAA1PRKAB1USP8
SCHEMBL20726513 0.81 EGFR (0.33)
SCHEMBL20726495 0.81 EGFR (0.35)
SCHEMBL20726527 0.78 USP2 (0.41) PRKAG1PRKAA1PRKAB1
SCHEMBL20726351 0.76 BRD4 (0.41) USP8

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-3083611-B1 OXINDOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE IN THE TREATMENT OF AMPK-RELATED DISEASES SANOFI SA (FR) 2019-02-13 EP disclosed