SCHEMBL3344083

SCHEMBL3344083

Cc1cc2ncccc2c(-c2ccc(Cl)cc2)c1CC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
PTGDR2 Q9Y5Y4 13/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
IL1B P01584 1/20 0.44
LMNA P02545 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL3331488 0.83 KDM4E (0.51) KDM4EPTGDR2SMN1; SMN2LMNAMEN1
SCHEMBL3297610 0.82 KDM4E (0.54) KDM4EPTGDR2SMN1; SMN2LMNAMEN1
SCHEMBL3303954 0.81 KDM4E (0.53) KDM4EPTGDR2SMN1; SMN2LMNAMEN1
SCHEMBL20021122 0.80 KDM4E (0.52) KDM4EPTGDR2SMN1; SMN2LMNAMEN1
SCHEMBL3323941 0.79 KDM4E (0.51) KDM4EPTGDR2SMN1; SMN2LMNAMEN1
SCHEMBL3324004 0.79 KDM4E (0.48) KDM4EPTGDR2SMN1; SMN2LMNA
SCHEMBL245240 0.78 NR4A2 (0.45) KDM4ESMN1; SMN2IL1BLMNAMEN1
SCHEMBL3314187 0.78 KDM4E (0.50) KDM4EPTGDR2SMN1; SMN2LMNAMEN1
SCHEMBL20020731 0.77 KDM4E (0.49) KDM4EPTGDR2SMN1; SMN2LMNA
SCHEMBL20021165 0.77 KDM4E (0.52) KDM4EPTGDR2SMN1; SMN2LMNAMEN1

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
WO-2012003498-A1 2 -QUINOLINYL- ACETIC ACID DERIVATIVES AS HIV ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2012-01-05 WO disclosed