SCHEMBL10568510

SCHEMBL10568510

CCCOC(=O)C1CCNC1(C(=O)O)C(=O)OCCC

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.38
PTPN1 P18031 1/20 0.38
PPP1CC P36873 1/20 0.38
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL9675417 0.85 SMN1; SMN2 (0.41) PPM1BPTPN1PPP1CCGAASMN1; SMN2
SCHEMBL9675194 0.74 CYP1A2 (0.32) PPM1BPTPN1PPP1CC
SCHEMBL9675102 0.72 CYP1A2 (0.34) PPM1BPTPN1PPP1CC
SCHEMBL17674468 0.69 ALDH1A1 (0.34) GAASMN1; SMN2
SCHEMBL16086418 0.66 HCAR2 (0.39) PPM1BPTPN1PPP1CCESR1
SCHEMBL294867 0.66 PPM1B (0.42) PPM1BPTPN1PPP1CCESR1ESR2
SCHEMBL6078331 0.65 LMNA (0.38) GAASMN1; SMN2
SCHEMBL25885236 0.64 PPM1B (0.45) PPM1BPTPN1PPP1CC
SCHEMBL16671106 0.64 MAPT (0.38) PPM1BPTPN1PPP1CC
SCHEMBL294366 0.63 PPM1B (0.47) PPM1BPTPN1PPP1CC

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-4874872-A Process for preparing (+)-2,3-dihydro-1H-pyrrolo[1,2-A]pyrrole-1,7-dicarboxylates SYNTEX (U.S.A.) INC. (US) 1989-10-17 US disclosed
US-4849526-A Process for preparing (±)-2,3-dihydro-1H-pyrrolo[1,2-A]pyrrole-1,7-dicarboxylates SYNTEX (U.S.A.) INC. (US) 1989-07-18 US disclosed