SCHEMBL21241026

SCHEMBL21241026

Cc1cc(C(=O)O)c(C)c(C2CC2)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
KDM4E B2RXH2 2/20 0.43
NOTUM Q6P988 4/20 0.43
GPR35 Q9HC97 2/20 0.41
CSNK2A1 P68400 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
TPMT P51580 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
MYC P01106 1/20 0.36
TTR P02766 1/20 0.36
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35
DRD3 P35462 1/20 0.35
POLB P06746 1/20 0.35
ABCC1 P33527 1/20 0.35
CAMKK2 Q96RR4 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
SCHEMBL27296746 0.84 MAPT (0.45) MAPTKDM4ENOTUMGPR35MEN1
SCHEMBL30410929 0.78 CSNK2A1 (0.48) MAPTNOTUMCSNK2A1MEN1KMT2A
SCHEMBL23062945 0.78 CSNK2A1 (0.53) MAPTNOTUMCSNK2A1MEN1KMT2A
SCHEMBL16421197 0.78 CSNK2A1 (0.48) MAPTNOTUMCSNK2A1MEN1KMT2A
SCHEMBL9244562 0.77 KDM4E (0.49) MAPTKDM4ENOTUMCSNK2A1MEN1
SCHEMBL3392534 0.77 KDM4E (0.58) KDM4ENOTUMGPR35CSNK2A1MEN1
SCHEMBL30280884 0.76 CAMKK2 (0.39) MAPTKDM4ENOTUMGPR35MEN1
SCHEMBL30281103 0.75 MAPT (0.37) MAPTKDM4ENOTUMGPR35MEN1
SCHEMBL27733843 0.75 MAPT (0.50) MAPTKDM4ENOTUMGPR35MEN1
SCHEMBL4969775 0.74 NOTUM (0.49) MAPTKDM4ENOTUMGPR35MEN1

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
WO-2019149260-A1 PYRIDAZINOL COMPOUND, DERIVATIVE THEREOF, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF 青岛清原化合物有限公司 2019-08-08 WO disclosed