SCHEMBL30612232

SCHEMBL30612232

O=C1C=C(c2c[nH]c3ccccc23)C(=O)N1c1c[nH]c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 1/20 0.50
PTPRF P10586 1/20 0.50
PTPN1 P18031 1/20 0.50
CDC25B P30305 1/20 0.50
SIRT2 Q8IXJ6 3/20 0.49
PIM1 P11309 3/20 0.49
CCNE2 O96020 2/20 0.49
CDK4 P11802 2/20 0.49
PRKACA P17612 2/20 0.49
PRKACG P22612 2/20 0.49
PRKACB P22694 2/20 0.49
CCND1 P24385 2/20 0.49
CCNE1 P24864 2/20 0.49
CDK2 P24941 2/20 0.49
PRKCB P05771 2/20 0.49
PRKCA P17252 2/20 0.49
SIRT1 Q96EB6 1/20 0.49
PRKD3 O94806 1/20 0.49
CCNB2 O95067 1/20 0.49
ABL1 P00519 1/20 0.49

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
SCHEMBL7816235 1.00 PTPRC (0.50) PTPRCPTPRFPTPN1CDC25BSIRT2
SCHEMBL3148486 0.86 MAPT (0.40) PTPRCPTPRFPTPN1CDC25BSIRT2
SCHEMBL3254214 0.85 PTPRC (0.45) PTPRCPTPRFPTPN1CDC25BSIRT2
SCHEMBL5879168 0.79 SIRT2 (0.63) PTPRCPTPRFPTPN1CDC25BSIRT2
SCHEMBL27910874 0.79 SIRT2 (0.41) PTPRCPTPRFPTPN1CDC25BSIRT2
SCHEMBL856333 0.75 TLR9 (0.52) SIRT2PIM1CCNE2CDK4PRKACA
SCHEMBL8476624 0.74 PRKACA (0.63) SIRT2PIM1CCNE2CDK4PRKACA
SCHEMBL8478364 0.73 CAMK2D (0.43) PTPRCPTPRFPTPN1CDC25BSIRT2
SCHEMBL7951074 0.73 PTPN1 (0.73) PTPRCPTPRFPTPN1CDC25BSIRT2
SCHEMBL8685666 0.72 CDK4 (0.52) PTPRCPTPRFPTPN1CDC25BSIRT2

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
CN-116761882-A Inducible stem cells 莫纳什大学 2023-09-15 CN disclosed