SCHEMBL4039532

SCHEMBL4039532

CCCC(C(=O)O)c1ccc(-c2ccc(C)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.48
PSIP1 O75475 5/20 0.46
FFAR1 O14842 1/20 0.45
SMN1; SMN2 Q16637 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
SCHEMBL4269790 0.95 POLB (0.51) POLBPSIP1SMN1; SMN2
SCHEMBL10896682 0.84 POLB (0.49) POLBSMN1; SMN2
SCHEMBL4037632 0.82 IDO1 (0.43) PSIP1
SCHEMBL9938570 0.81 LMNA (0.49) POLBFFAR1SMN1; SMN2
SCHEMBL11762062 0.81 MMP13 (0.46)
SCHEMBL4038598 0.81 PSEN1 (0.61) FFAR1
SCHEMBL633268 0.80 ESR1 (0.49)
SCHEMBL643461 0.80 CYP2C19 (0.53) POLBSMN1; SMN2
SCHEMBL19228532 0.80 CYP2C19 (0.53) POLBSMN1; SMN2
SCHEMBL510548 0.80 ALDH1A1 (0.56) POLBSMN1; SMN2

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-2074093-A2 MATRIX METALLOPROTEINASE INHIBITORS Ranbaxy Laboratories Limited (IN) 2009-07-01 EP claimed
WO-2008023336-A2 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2008-02-28 WO claimed