SCHEMBL25919977

SCHEMBL25919977

BCCOc1ccc(N(C)C)c(C(F)(F)F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
NOTUM Q6P988 1/20 0.36
CRHR1 P34998 3/20 0.34
GPR84 Q9NQS5 1/20 0.34
PDK2 Q15119 2/20 0.33
CYP17A1 P05093 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
PTGES O14684 1/20 0.32
ALOX5 P09917 1/20 0.32
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA7 P36544 1/20 0.32
CHRNA4 P43681 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
APP P05067 2/20 0.31

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
SCHEMBL14922305 0.71 THRA (0.45) THRATHRBPDK2CHRNB2CHRNA4
SCHEMBL25919978 0.71 DRD2 (0.40)
SCHEMBL14922255 0.69 THRA (0.38) THRATHRBPDK2CYP2C19L3MBTL1
SCHEMBL25317341 0.68 THRA (0.37) THRATHRBCRHR1GPR84PTGES
SCHEMBL12017814 0.68 NOTUM (0.44) NOTUMCRHR1ALDH1A1
SCHEMBL9233640 0.68 NOTUM (0.44) NOTUMCRHR1
SCHEMBL19649433 0.67 PDK2 (0.46) THRATHRBGPR84PDK2PTGES
SCHEMBL6718732 0.67 THRA (0.48) THRATHRBPDK2CHRNB2CHRNA4
SCHEMBL6846758 0.66 GAA (0.55) NOTUMCRHR1KDM4EALDH1A1
SCHEMBL619545 0.66 NOTUM (0.40) NOTUMCRHR1

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-2023141432-A2 APOL1 INHIBITORS AND METHODS OF USE MAZE THERAPEUTICS, INC. (US) 2023-07-27 WO disclosed