SCHEMBL4192784

SCHEMBL4192784

CC1=CC(C)(C)Nc2cc(F)cc(C#N)c21

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 19/20 0.48
▸ AR P10275 6/20 0.48
▸ NR3C1 P04150 3/20 0.44
▸ NR3C2 P08235 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39

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
SCHEMBL4207661 0.79 PGR (0.53) PGRARNR3C1NR3C2KDM4E
SCHEMBL13747310 0.76 PGR (0.47) PGRARNR3C1NR3C2KDM4E
SCHEMBL4189937 0.67 PGR (0.67) PGRARNR3C1NR3C2KDM4E
SCHEMBL4196337 0.66 PGR (0.39) PGRARNR3C1NR3C2KDM4E
SCHEMBL4183779 0.65 PGR (1.00) PGRARNR3C1NR3C2KDM4E
SCHEMBL17570611 0.64 TRPV4 (0.38) AR
SCHEMBL12990550 0.64 KDM4E (0.46) PGRARNR3C1NR3C2KDM4E
SCHEMBL8136368 0.63 ALDH1A1 (0.46) PGRARNR3C1NR3C2KDM4E
SCHEMBL20562679 0.63 TSHR (0.38) ARKDM4EALDH1A1
SCHEMBL4193682 0.63 NR3C1 (0.40) PGRARNR3C1NR3C2

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
WO-2009103007-A2 STEROID HORMONE RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-08-20 — — WO disclosed
WO-2009103007-A2 STEROID HORMONE RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-08-20 — — WO disclosed
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