SCHEMBL13747310

SCHEMBL13747310

CC1=CC(C)(C)Nc2cc(F)cc(Cl)c21

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 18/20 0.47
▸ AR P10275 4/20 0.42
▸ NR3C1 P04150 4/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ NR3C2 P08235 1/20 0.40

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 0.83 PGR (0.53) PGRARNR3C1KDM4EALDH1A1
SCHEMBL4192784 0.76 PGR (0.48) PGRARNR3C1KDM4EALDH1A1
SCHEMBL4188241 0.72 PGR (0.38) PGRARNR3C1KDM4EALDH1A1
SCHEMBL9709027 0.66 ALDH1A1 (0.48) PGRARNR3C1KDM4EALDH1A1
SCHEMBL29677108 0.66 PGR (0.70) PGRARNR3C1KDM4EALDH1A1
SCHEMBL16812765 0.66 PGR (0.70) PGRARNR3C1KDM4EALDH1A1
SCHEMBL30973139 0.65 KDM4E (0.83) PGRARKDM4EALDH1A1MAPT
SCHEMBL6648733 0.64 PGR (1.00) PGRARNR3C1NR3C2
SCHEMBL4175883 0.64 PGR (1.00) PGRARNR3C1KDM4EALDH1A1
SCHEMBL12990550 0.63 KDM4E (0.46) PGRARNR3C1KDM4EALDH1A1

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