SCHEMBL20038682

SCHEMBL20038682

Cc1c(C(C)C)c(C)c(S(=O)(=O)O)c(C)c1C(C)C

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.43
FABP4 P15090 1/20 0.43
FABP5 Q01469 1/20 0.43

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
SCHEMBL14883084 0.90 FABP3 (0.43) FABP3FABP4FABP5
SCHEMBL2862401 0.78 FABP4 (0.37) FABP3FABP4FABP5
SCHEMBL2869222 0.75 FABP4 (0.38) FABP3FABP4FABP5
SCHEMBL9792986 0.75 FABP3 (0.39) FABP3FABP4FABP5
SCHEMBL11149902 0.74 FABP4 (0.36) FABP3FABP4FABP5
SCHEMBL19199534 0.73 FABP3 (0.42) FABP3FABP4FABP5
SCHEMBL11915412 0.73 FABP4 (0.56) FABP3FABP4FABP5
Ammonia Solution, Strong SCHEMBL9809148 0.73 FABP4 (0.36) FABP3FABP4FABP5
SCHEMBL83879 0.73 FABP4 (0.36) FABP3FABP4FABP5
Hydrochloric Acid SCHEMBL11010689 0.73 FABP4 (0.36) FABP3FABP4FABP5

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-3102637-B1 METHOD FOR PURIFICATION OF ANTIBODIES, ANTIBODY FRAGMENTS OR ENGINEERED VARIANTS THEREOF USING SPECIFIC ANTHRAQUINONE DYE-LIGAND STRUCTURES BASF SE (DE) 2018-04-11 EP disclosed