SCHEMBL12177416

SCHEMBL12177416

COc1ccc(CN2C(=O)S/C(=C\c3cccc(-c4ccccc4)c3)C2=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 7/20 0.60
▸ ACP1 P24666 7/20 0.60
▸ PPARG P37231 2/20 0.60
▸ ENPP2 Q13822 6/20 0.58
▸ PIM1 P11309 1/20 0.58
▸ AKR1B1 P15121 1/20 0.58
▸ CISD1 Q9NZ45 1/20 0.56
▸ PTPN2 P17706 3/20 0.55
▸ PTPRF P10586 1/20 0.55
▸ PTPRB P23467 1/20 0.55

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
SCHEMBL12177549 0.97 PPARG (0.64) PTPN1ACP1PPARGENPP2PIM1
SCHEMBL12177353 0.97 PIM1 (0.59) PTPN1ACP1PPARGENPP2PIM1
SCHEMBL12177785 0.93 PIM1 (0.56) PTPN1ACP1PPARGENPP2PIM1
SCHEMBL12177324 0.93 PPARG (0.62) PTPN1ACP1PPARGENPP2PIM1
SCHEMBL12177458 0.91 PTPN1 (0.71) PTPN1ACP1ENPP2PTPN2PTPRF
SCHEMBL12177396 0.90 ENPP2 (0.68) PTPN1ACP1ENPP2AKR1B1PTPN2
SCHEMBL12177684 0.90 ENPP2 (0.67) PTPN1ACP1PPARGENPP2AKR1B1
SCHEMBL12177475 0.89 PPARG (0.73) PTPN1ACP1PPARGENPP2PIM1
SCHEMBL12177161 0.88 PPARG (0.64) PTPN1ACP1PPARGENPP2PIM1
SCHEMBL12177385 0.87 ENPP2 (0.71) PTPN1ACP1PPARGENPP2PTPN2

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-2011135303-A2 UBIQUITINATION MODULATORS ITI SCOTLAND LIMITED (GB) 2011-11-03 — — WO disclosed
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