SCHEMBL6987047

SCHEMBL6987047

[O]CCc1cc(Cl)nc(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 1/20 0.37
FFAR1 O14842 1/20 0.36
RECQL P46063 1/20 0.31
LOX P28300 1/20 0.31
LOXL3 P58215 1/20 0.31
LOXL2 Q9Y4K0 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31
HSP90AB1 P08238 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
SCHEMBL7349172 0.85 SMN1; SMN2 (0.40) ALDH1A1
SCHEMBL5898392 0.79 S1PR2 (0.39) S1PR2FFAR1RECQLLOXLOXL3
SCHEMBL6987053 0.75 RECQL (0.40) S1PR2FFAR1RECQLLOXLOXL3
SCHEMBL5751544 0.75 ALDH1A1 (0.45) S1PR2FFAR1RECQLALDH1A1RAB9A
SCHEMBL15517369 0.75 FFAR1 (0.33) S1PR2FFAR1RECQLLOXLOXL3
SCHEMBL27704309 0.75 TDP1 (0.39) S1PR2FFAR1RECQLLOXLOXL3
SCHEMBL9687371 0.74 TSHR (0.44)
SCHEMBL190086 0.73 RECQL (0.41) S1PR2FFAR1RECQLLOXLOXL3
SCHEMBL23794707 0.72 S1PR2 (0.35) S1PR2FFAR1RECQL
SCHEMBL5749827 0.71 RAB9A (0.47) ALDH1A1RAB9A

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-1299379-A2 LACTAM METALLOPROTEASE INHIBITORS Bristol-Myers Squibb Pharma Company (US) 2003-04-09 EP disclosed
WO-2002004416-A2 LACTAM METALLOPROTEASE INHIBITORS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-01-17 WO disclosed