SCHEMBL9640228

SCHEMBL9640228

CC1CC2OC2CC1C(C(CCCC(=O)O)C(=O)O)C1CC2OC2CC1C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.35
CYP1A2 P05177 1/20 0.32
PPP5C P53041 1/20 0.30
DPP4 P27487 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 1/20 0.30

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
SCHEMBL1741023 0.77 PPM1B (0.42) PPM1BCYP1A2DPP4DPP8DPP9
Adipic Acid SCHEMBL28589647 0.75 LMNA (0.46) PPP5C
SCHEMBL669772 0.72 FOLH1 (0.39) PPM1BCYP1A2PPP5CDPP4DPP8
SCHEMBL25353831 0.67 PPP5C (0.35) PPP5C
SCHEMBL27304727 0.65 TSHR (0.38) PPP5C
SCHEMBL9002916 0.65 PPM1B (0.43) PPM1BCYP1A2DPP4DPP8DPP9
SCHEMBL2231184 0.65 AKR1B1 (0.43) CYP1A2
SCHEMBL455125 0.64 CYP1A2 (0.48) CYP1A2
SCHEMBL10037209 0.64 CYP1A2 (0.48) CYP1A2
Adipic Acid SCHEMBL27902649 0.63 PPM1B (0.41) PPM1B

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-0257757-B1 COATED ABRASIVE HAVING RADIATION CURABLE BINDER MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-08-26 EP claimed