SCHEMBL10962139

SCHEMBL10962139

O=C1C=C(C2CCC2)C(=O)O1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
PTPN1 P18031 2/20 0.39
PTPRC P08575 1/20 0.38
PTPRF P10586 1/20 0.38
CDC25B P30305 1/20 0.38
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL27893146 0.96 MAOA (0.45) MAOAMAOBPTPN1PTPRCPTPRF
SCHEMBL1898536 0.94 PTPN1 (0.44) MAOAMAOBPTPN1PTPRCPTPRF
Maleic Anhydride SCHEMBL27689320 0.87 MAOA (0.43) MAOAMAOBPTPN1PTPRCPTPRF
SCHEMBL27509578 0.74 MAOA (0.41) MAOAMAOBPTPN1PTPRCPTPRF
SCHEMBL28097089 0.68 ALDH1A1 (0.34) ALDH1A1TP53MAPTMAPK1SMN1; SMN2
SCHEMBL8626050 0.66
SCHEMBL30121628 0.65 MAOA (0.34) MAOAMAOBPTPN1PTPRCPTPRF
SCHEMBL28883091 0.64 ALDH1A1 (0.32) ALDH1A1TP53MAPTMAPK1SMN1; SMN2
SCHEMBL9099226 0.64
SCHEMBL10781942 0.62 MAOA (0.64) MAOAMAOBPTPN1PTPRCPTPRF

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4556111-A ADDUCTS OF HALEIC ANHYDRIDE AND OIILS, OIL & GAS WELLS PHILLIPS PETROLEUM COMPANY (US) 1985-12-03 US disclosed
US-3960937-A REACTION PRODUCT OF PETROLEUM SULFONIC ACIDS, POLYAMINES, CYCLIC ANHYDRIDES PHILLIPS PETROLEUM COMPANY (US) 1976-06-01 US disclosed