SCHEMBL9675102

SCHEMBL9675102

COC(=O)C1CCNC1(C(=O)O)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.34
HIF1A Q16665 1/20 0.34
PPM1B O75688 1/20 0.33
PTPN1 P18031 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
PPP1CC P36873 1/20 0.33
ATM Q13315 2/20 0.33
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CHRNB2 P17787 2/20 0.32
CHRNA4 P43681 2/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA7 P36544 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM3 P20309 1/20 0.31

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
SCHEMBL9675194 0.91 CYP1A2 (0.32) CYP1A2HIF1APPM1BPTPN1CYP2C9
SCHEMBL5203788 0.80 LMNA (0.37) CYP1A2HIF1APPM1BPTPN1CYP2C9
SCHEMBL5203793 0.80 LMNA (0.37) CYP1A2HIF1APPM1BPTPN1CYP2C9
SCHEMBL5203785 0.80 LMNA (0.37) CYP1A2HIF1APPM1BPTPN1CYP2C9
SCHEMBL9675417 0.74 SMN1; SMN2 (0.41) PPM1BPTPN1PPP1CC
SCHEMBL10568510 0.72 PPM1B (0.38) PPM1BPTPN1PPP1CC
SCHEMBL7331670 0.67 GABRP (0.31) TSHR
SCHEMBL26694795 0.67 MAPT (0.36) PPM1BPTPN1CYP2C9CYP2C19PPP1CC
SCHEMBL17723437 0.67 CHRNB2 (0.35) CYP1A2HIF1APPM1BPTPN1CYP2C9
Hydrochloric Acid SCHEMBL17714300 0.66 CHRNB2 (0.34) CYP1A2HIF1ACYP2C9TSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0275092-B1 PROCESS FOR PREPARING (+)-1,2-DIHYDRO-3H-PYRROLO(1,2-A)PYRROLE-1,7-DICARBOXYLATES SYNTEX (U.S.A.) INC. (US) 1992-06-03 EP disclosed
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
EP-0275092-A1 Process for preparing (+)-1,2-dihydro-3H-pyrrolo(1,2-a)pyrrole-1,7-dicarboxylates SYNTEX (U.S.A.) INC. (US) 1988-07-20 EP disclosed