SCHEMBL9572016

SCHEMBL9572016

O=C1C=C(c2c[nH]c3ccccc23)C(=O)c2ccccc21

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.77
PTPRC P08575 2/20 0.77
PTPRF P10586 1/20 0.77
CDC25B P30305 1/20 0.77
SIRT2 Q8IXJ6 3/20 0.54
PRKCB P05771 2/20 0.54
PRKCA P17252 2/20 0.54
PRKD3 O94806 1/20 0.54
CCNB2 O95067 1/20 0.54
CCNE2 O96020 1/20 0.54
ABL1 P00519 1/20 0.54
PRKCG P05129 1/20 0.54
CDK1 P06493 1/20 0.54
PIM1 P11309 1/20 0.54
CDK4 P11802 1/20 0.54
CCNB1 P14635 1/20 0.54
PRKACA P17612 1/20 0.54
PRKACG P22612 1/20 0.54
PRKACB P22694 1/20 0.54
CCND1 P24385 1/20 0.54

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
SCHEMBL8992461 0.87 PTPN1 (1.00) PTPN1PTPRCPTPRFCDC25BSIRT2
SCHEMBL7951074 0.84 PTPN1 (0.73) PTPN1PTPRCPTPRFCDC25BSIRT2
SCHEMBL28503581 0.83 PTPN1 (0.55) PTPN1PTPRCPTPRFCDC25BCCNE2
SCHEMBL28906711 0.83 PTPN1 (0.55) PTPN1PTPRCPTPRFCDC25BPRKCB
SCHEMBL28514484 0.83 PTPN1 (0.55) PTPN1PTPRCPTPRFCDC25BCCNB2
SCHEMBL28506037 0.83 PTPN1 (0.55) PTPN1PTPRCPTPRFCDC25BBACE1
SCHEMBL27898411 0.81 PTPN1 (0.64) PTPN1PTPRCPTPRFCDC25BSIRT2
SCHEMBL28508263 0.80 PTPN1 (0.51) PTPN1PTPRCPTPRFCDC25BPRKD3
SCHEMBL28516065 0.80 PTPN1 (0.51) PTPN1PTPRCPTPRFCDC25BCCNB2
SCHEMBL28506448 0.78 PTPRC (0.49) PTPN1PTPRCPTPRFCDC25BCCNB2

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-0560683-A1 Hair coloring compositions with monoindolyl-1,4-naphthoquinones or their leuko derivatives, new monoindolyl-1,4-naphthoquinones and their leukoderivatives L'OREAL (FR) 1993-09-15 EP disclosed