SCHEMBL3897289

SCHEMBL3897289

CC(Cc1ccc(OCc2ccccc2F)c(-c2ccc3ccccc3c2)c1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 16/20 0.52
PTGER1 P34995 2/20 0.49
PTGER4 P35408 2/20 0.49
PTGER3 P43115 2/20 0.49
PTGER2 P43116 2/20 0.49
PTPN2 P17706 14/20 0.47
CDC25B P30305 14/20 0.47
AKR1C3 P42330 2/20 0.47
AKR1C2 P52895 2/20 0.47
PTPN6 P29350 7/20 0.44

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
SCHEMBL3881338 0.90 PTPN1 (0.46) PTPN1PTGER1PTGER4PTGER3PTGER2
SCHEMBL3883530 0.88 PTGER1 (0.53) PTGER1PTGER4PTGER3PTGER2AKR1C3
SCHEMBL3887505 0.88 PTGER1 (0.46) PTPN1PTGER1PTGER4PTGER3PTGER2
SCHEMBL3891271 0.88 PTGER1 (0.57) PTGER1PTGER4PTGER3PTGER2AKR1C3
SCHEMBL3885358 0.86 PTPN1 (0.46) PTPN1PTGER1PTGER4PTGER3PTGER2
SCHEMBL3882133 0.85 PTGER1 (0.51) PTGER1PTGER4PTGER3PTGER2AKR1C3
SCHEMBL3882422 0.83 PPARA (0.49) PTGER1PTGER4PTGER3PTGER2AKR1C3
SCHEMBL3884690 0.83 FFAR4 (0.60) PTGER1PTGER4PTGER3PTGER2
SCHEMBL3894526 0.82 PPARG (0.47) PTGER1PTGER4PTGER3PTGER2
SCHEMBL3883909 0.82 PPARG (0.45) PTGER1PTGER4PTGER3PTGER2AKR1C3

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-1477472-B1 SUBSTITUTED PHENYLALKANOIC ACID DERIVATIVE AND USE THEREOF ASAHI KASEI PHARMA CORP (JP) 2009-01-14 EP claimed