SCHEMBL21557586

SCHEMBL21557586

O=C(O)C1CCc2ccc(-c3ccccn3)cc2C1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FAAH O00519 17/20 0.55
CYP4F2 P78329 1/20 0.45
CYP4A11 Q02928 1/20 0.45
ABL1 P00519 1/20 0.45

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
SCHEMBL21557425 0.89 FAAH (0.58) FAAHABL1
SCHEMBL30664942 0.89 FAAH (0.58) FAAHABL1
SCHEMBL31404170 0.89 FAAH (0.58) FAAHABL1
SCHEMBL26656409 0.89 FAAH (0.58) FAAHABL1
SCHEMBL26656354 0.89 FAAH (0.58) FAAHABL1
SCHEMBL31404151 0.89 FAAH (0.58) FAAHABL1
SCHEMBL7216619 0.82 FAAH (0.55) FAAH
SCHEMBL21557486 0.81 FFAR1 (0.47) FAAHABL1
SCHEMBL21557499 0.78 MAP4K4 (0.50) FAAHABL1
SCHEMBL21557666 0.78 CYP4F2 (0.47) FAAHCYP4F2CYP4A11ABL1

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-3566749-A1 THIAZOLE DERIVATIVE AND APPLICATIONS THEREOF Medshine Discovery Inc. (CN) 2019-11-13 EP disclosed