SCHEMBL9829296

SCHEMBL9829296

COc1cccc(C(=O)NC(Cc2ccc(O)cc2)C(=O)O)c1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR132 Q9UNW8 9/20 0.67
GPR139 Q6DWJ6 2/20 0.63
PTPN1 P18031 1/20 0.59
CMKLR2 P46091 1/20 0.58
CMKLR1 Q99788 1/20 0.58
LNPEP Q9UIQ6 1/20 0.57
CTSL P07711 1/20 0.55
CA2 P00918 1/20 0.55
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
TAS1R3 Q7RTX0 1/20 0.54
TAS1R1 Q7RTX1 1/20 0.54
ALB P02768 1/20 0.53
IL2 P60568 1/20 0.53

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
SCHEMBL9829301 1.00 GPR132 (0.67) GPR132GPR139PTPN1CMKLR2CMKLR1
SCHEMBL4173706 0.91 GPR132 (0.76) GPR132GPR139PTPN1CMKLR2CMKLR1
SCHEMBL18114395 0.88 GPR132 (0.81) GPR132GPR139PTPN1CMKLR2CMKLR1
SCHEMBL18127321 0.85 GPR132 (0.61) GPR132GPR139PTPN1CMKLR2CMKLR1
SCHEMBL8667629 0.85 CA2 (0.72) GPR132PTPN1LNPEPCTSLCA2
SCHEMBL8671908 0.85 CA2 (0.72) GPR132PTPN1LNPEPCTSLCA2
SCHEMBL5926365 0.83 PTPN1 (0.62) GPR132GPR139PTPN1CTSLCA2
SCHEMBL31389144 0.83 GPR139 (0.72) GPR132GPR139CMKLR2CMKLR1CTSL
SCHEMBL4178541 0.83 GPR139 (0.72) GPR132GPR139CMKLR2CMKLR1CTSL
SCHEMBL5926200 0.82 PTPN1 (0.64) GPR132GPR139PTPN1CTSLCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP disclosed