SCHEMBL20535149

SCHEMBL20535149

COc1ccc(F)cc1C(C)CC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSA P10619 17/20 0.50
FFAR1 O14842 1/20 0.45
FFAR4 Q5NUL3 1/20 0.45
MMEL1 Q495T6 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
SCHEMBL20855727 0.84 CTSA (0.49) CTSA
SCHEMBL1208785 0.83 CTSA (0.50) CTSA
SCHEMBL22692590 0.83 ADRA1A (0.54) CTSAFFAR1
SCHEMBL2691040 0.82 CTSA (0.48) CTSA
SCHEMBL1207026 0.82 POLB (0.57) CTSAFFAR1
SCHEMBL30040417 0.82 POLB (0.57) CTSAFFAR1
SCHEMBL17755382 0.82 KDM4E (0.46)
SCHEMBL16737884 0.81 HTR2A (0.40) CTSA
SCHEMBL16737885 0.81 HTR2A (0.40) CTSA
SCHEMBL21632110 0.80 KMT2A (0.48) CTSAFFAR1

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-3609869-A1 SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF Bayer Aktiengesellschaft (DE) 2020-02-19 EP disclosed
WO-2018189011-A1 SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2018-10-18 WO disclosed