SCHEMBL11264841

SCHEMBL11264841

Cc1cc(C(F)(F)C(O)(F)C(F)(F)F)cc(C)c1NCCN

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
AR P10275 1/20 0.31
VDR P11473 1/20 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
SCHEMBL11272367 0.91 MEN1 (0.33)
SCHEMBL11276954 0.86 IL1B (0.35) KDM4EARVDR
SCHEMBL11264839 0.84 NR1H2 (0.35) AR
Hydrochloric Acid SCHEMBL11266399 0.83 ACHE (0.30) ARVDR
SCHEMBL11267067 0.81 KMT2A (0.41) KDM4E
SCHEMBL11267621 0.81 HTT (0.44)
SCHEMBL11261899 0.79 TACR1 (0.32) KDM4EVDR
SCHEMBL11266630 0.77 ALDH1A1 (0.38) KDM4EVDR
SCHEMBL11624160 0.76 MEN1 (0.35)
SCHEMBL11272364 0.75 NR1H2 (0.35)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4322434-A N-Substituted-4-(polyfluoro-2-hydroxy-2-propyl)anilines and compounds related thereto SCHERING CORPORATION (US) 1982-03-30 US claimed
US-4322434-A N-Substituted-4-(polyfluoro-2-hydroxy-2-propyl)anilines and compounds related thereto SCHERING CORPORATION (US) 1982-03-30 US disclosed
US-4267193-A N-substituted-4-(polyfluoro-2-hydroxy-2-propyl)anilines and compounds related thereto SCHERING CORPORATION (US) 1981-05-12 US disclosed