SCHEMBL24459355

SCHEMBL24459355

COC(=O)Nc1cc(C(F)(F)F)ccc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.54
KMT2A Q03164 5/20 0.54
MEN1 O00255 4/20 0.54
HTT P42858 3/20 0.54
TSHR P16473 1/20 0.54
TAS2R14 Q9NYV8 1/20 0.52
HPGD P15428 2/20 0.49
GAA P10253 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
BRAF P15056 1/20 0.46
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPK1 P28482 2/20 0.46
LMNA P02545 1/20 0.46
RAB9A P51151 1/20 0.46
CFTR P13569 1/20 0.45
TNIK Q9UKE5 1/20 0.45
PKM P14618 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
SCHEMBL28797274 0.86 RXFP1 (0.54) MAPTKMT2AMEN1HTTTSHR
SCHEMBL11055173 0.85 TAS2R14 (0.60) MAPTKMT2AMEN1HTTTSHR
SCHEMBL5166111 0.83 CYP1A2 (0.60) MAPTKMT2AMEN1HTTTSHR
SCHEMBL28141674 0.82 TAS2R14 (0.57) MAPTKMT2AMEN1HTTTSHR
SCHEMBL18615673 0.82 ALDH1A1 (0.54) MAPTKMT2AMEN1HTTTAS2R14
SCHEMBL2096162 0.81 MAPT (0.51) MAPTKMT2AMEN1HTTTSHR
SCHEMBL4463318 0.81 TAS2R14 (0.52) MAPTKMT2AMEN1HTTTSHR
SCHEMBL8346848 0.79 MAPT (0.56) MAPTKMT2AMEN1HTTTSHR
SCHEMBL29645247 0.79 HPGD (0.75) MAPTKMT2AMEN1TSHRHPGD
SCHEMBL29645245 0.79 HPGD (0.75) MAPTKMT2AMEN1TSHRHPGD

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-2022109363-A1 NOVEL SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. (US) 2022-05-27 WO disclosed