SCHEMBL26047259

SCHEMBL26047259

Cc1ccc(Nc2sc3nc(C)ccc3c2C(=O)NOCCCO)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.42
MAP2K2 P36507 2/20 0.40
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
USP25 Q9UHP3 1/20 0.35

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
SCHEMBL24350870 0.95 MAP2K1 (0.44) MAP2K1MAP2K2CYP3A4CYP2C9CYP2C19
SCHEMBL24906352 0.89 MAP2K1 (0.39) MAP2K1MAP2K2USP25
SCHEMBL24906170 0.86 MAP2K1 (0.47) MAP2K1MAP2K2
SCHEMBL24906315 0.86 MAP2K1 (0.47) MAP2K1MAP2K2
SCHEMBL26047253 0.86 MAP2K1 (0.47) MAP2K1MAP2K2
SCHEMBL24906181 0.86 CSF1R (0.39) MAP2K1MAP2K2USP25
SCHEMBL30034958 0.86 MAP2K1 (0.55) MAP2K1MAP2K2CYP3A4CYP2C9CYP2C19
SCHEMBL20565703 0.86 MAP2K1 (0.55) MAP2K1MAP2K2CYP3A4CYP2C9CYP2C19
SCHEMBL26047319 0.86 MAP2K1 (0.43) MAP2K1MAP2K2
SCHEMBL22045814 0.85 MAP2K1 (0.43) MAP2K1MAP2K2USP25

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
EP-4233834-A2 ARYL-ANILINE AND HETEROARYL-ANILINE COMPOUNDS FOR TREATMENT OF BIRTHMARKS NFlection Therapeutics, Inc. (US) 2023-08-30 EP disclosed
EP-4233865-A2 ARYL-ANILINE AND HETEROARYL-ANILINE COMPOUNDS FOR TREATMENT OF SKIN CANCERS NFlection Therapeutics, Inc. (US) 2023-08-30 EP disclosed