SCHEMBL7877679

SCHEMBL7877679

C=CCOC(=O)N1CCC1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.48
SIGMAR1 Q99720 1/20 0.40
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CHRM1 P11229 1/20 0.37
ELANE P08246 5/20 0.36
CTSG P08311 2/20 0.36
CYP19A1 P11511 1/20 0.36
F2 P00734 2/20 0.34
ACE P12821 3/20 0.34
LMNA P02545 2/20 0.33
MAPK1 P28482 1/20 0.33
GAA P10253 1/20 0.33
REN P00797 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL5702004 1.00 RAB9A (0.48) RAB9ASIGMAR1ALDH1A1SMN1; SMN2CHRM1
SCHEMBL5702051 1.00 RAB9A (0.48) RAB9ASIGMAR1ALDH1A1SMN1; SMN2CHRM1
SCHEMBL10683300 0.90 RAB9A (0.60) RAB9AALDH1A1SMN1; SMN2F2ACE
SCHEMBL8667871 0.90 RAB9A (0.60) RAB9AALDH1A1SMN1; SMN2F2ACE
SCHEMBL8667874 0.90 RAB9A (0.60) RAB9AALDH1A1SMN1; SMN2F2ACE
SCHEMBL9193401 0.89 RAB9A (0.55) RAB9AALDH1A1SMN1; SMN2F2ACE
SCHEMBL7173020 0.89 RAB9A (0.55) RAB9AALDH1A1SMN1; SMN2F2ACE
SCHEMBL2769691 0.83 CYP19A1 (0.48) RAB9ASIGMAR1ALDH1A1SMN1; SMN2CHRM1
SCHEMBL28339063 0.81 RAB9A (0.38) RAB9ASIGMAR1ALDH1A1CHRM1CYP19A1
SCHEMBL9386450 0.81 RAB9A (0.40) RAB9ASIGMAR1CHRM1ELANECYP19A1

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-6313315-B1 RESOLUTION; ENANTIOMORPHIC PURIFICATION; CRYSTALLIZATION IN SOLVENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-11-06 US disclosed
EP-1057810-A1 Method for producing n-protected-azetidine-2-carboxylic acids SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-12-06 EP disclosed