SCHEMBL10607697

SCHEMBL10607697

CC(C)[C@@H](C(=O)ON)c1ccc(Cl)cc1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 17/20 0.59
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ADRB2 P07550 1/20 0.45
LMNA P02545 1/20 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
SCHEMBL10614521 0.87 FFAR2 (0.61) FFAR2MEN1KMT2AADRB2LMNA
SCHEMBL10614514 0.87 FFAR2 (0.61) FFAR2MEN1KMT2AADRB2LMNA
SCHEMBL9862938 0.85 FFAR2 (0.59) FFAR2MEN1KMT2AADRB2LMNA
SCHEMBL11400312 0.85 FFAR2 (0.59) FFAR2MEN1KMT2AADRB2LMNA
SCHEMBL2423106 0.85 FFAR2 (0.64) FFAR2MEN1KMT2ALMNA
SCHEMBL23027132 0.82 FFAR2 (0.56) FFAR2MEN1KMT2ALMNA
SCHEMBL10867395 0.82 FFAR2 (0.56) FFAR2MEN1KMT2ALMNA
SCHEMBL11062117 0.82 FFAR2 (0.56) FFAR2MEN1KMT2ALMNA
SCHEMBL1677147 0.81 FFAR2 (0.62) FFAR2MEN1KMT2AADRB2LMNA
SCHEMBL1677071 0.81 FFAR2 (0.62) FFAR2MEN1KMT2AADRB2LMNA

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
EP-0163094-B1 PREPARATION OF OPTICALLY-ACTIVE ALPHA-SUBSTITUTED PHENYLACETIC ACIDS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-08-02 EP disclosed
EP-0163094-A2 Preparation of optically-active alpha-substituted phenylacetic acids E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-12-04 EP disclosed