SCHEMBL4423944

SCHEMBL4423944

CCC(Cc1ccccc1)(C(=O)c1ccc(SCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1)N(C)C

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 3/20 0.34
HDAC1 Q13547 1/20 0.32
KMT2A Q03164 1/20 0.31
RAB9A P51151 2/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL4413856 1.00 MLYCD (0.34) MLYCDHDAC1KMT2ARAB9ANPC1
SCHEMBL13893673 0.83 HDAC1 (0.34) MLYCDHDAC1KMT2ARAB9ANPC1
SCHEMBL8898813 0.82 HDAC1 (0.37) MLYCDHDAC1KMT2ARAB9ANPC1
SCHEMBL4415863 0.81 THRA (0.34) MLYCD
SCHEMBL8898167 0.80 ALDH1A1 (0.38) MLYCDHDAC1KMT2ARAB9ANPC1
SCHEMBL8176384 0.79 THRA (0.40) MLYCDHDAC1KMT2ARAB9ANPC1
SCHEMBL8898371 0.79 THRB (0.50) HDAC1KMT2AALDH1A1
SCHEMBL8897532 0.79 THRB (0.45) HDAC1KMT2ARAB9ANPC1ALDH1A1
SCHEMBL8897938 0.77 TAS2R14 (0.43) MLYCDKMT2ARAB9ANPC1ALDH1A1
SCHEMBL8175445 0.77 THRA (0.38) HDAC1KMT2ARAB9ANPC1ALDH1A1

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-10961405-B2 Fluorine-containing acetophenone derivative, fluroine based additive, curable composition including same, and cured product thereof DIC CORPORATION (JP) 2021-03-30 US disclosed
EP-1392779-B1 FLUORINATED-PHOTOINITIATORS IN DUAL CURE RESINS CIBA HOLDING INC (CH) 2009-04-22 EP disclosed
US-20040067311-A1 Fluorinated-photoinitiators in dual cure resins CIBA SPECIALTY CHEMICALS CORP. 2004-04-08 US disclosed