SCHEMBL11375319

SCHEMBL11375319

CC(=O)c1c(-c2ccccc2)[nH]n(C)c1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.59
▸ ALDH1A1 P00352 4/20 0.59
▸ CSF1R P07333 1/20 0.49
▸ FGFR1 P11362 1/20 0.49
▸ FLT1 P17948 1/20 0.49
▸ KDR P35968 1/20 0.49
▸ CSNK1A1 P48729 1/20 0.49
▸ CDK8 P49336 1/20 0.49
▸ GSK3A P49840 1/20 0.49
▸ GSK3B P49841 1/20 0.49
▸ CDK5 Q00535 1/20 0.49
▸ PRKCQ Q04759 1/20 0.49
▸ LRRK2 Q5S007 1/20 0.49
▸ CLK4 Q9HAZ1 1/20 0.49
▸ DYRK1B Q9Y463 1/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ MEN1 O00255 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41

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
SCHEMBL11384130 0.81 KMT2A (0.56) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL17290521 0.76 ALDH1A1 (0.67) KDM4EALDH1A1CDK8SMN1; SMN2MEN1
SCHEMBL11519413 0.75 ALDH1A1 (0.57) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL23403346 0.75 KDM4E (0.57) KDM4EALDH1A1CDK8SMN1; SMN2MEN1
SCHEMBL23403609 0.75 KDM4E (0.57) KDM4EALDH1A1CDK8SMN1; SMN2MEN1
SCHEMBL10961526 0.74 KDM4E (0.55) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL11775287 0.74 KDM4E (0.55) KDM4EALDH1A1CSF1RFGFR1FLT1
SCHEMBL17792533 0.73 KDM4E (0.48) KDM4EALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL23399055 0.71 ALDH1A1 (0.53) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL23399304 0.71 ALDH1A1 (0.53) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A

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
US-4260776-A PYRAZOLONE BAYER AKTIENGESELLSCHAFT (DE) 1981-04-07 — — US disclosed
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