SCHEMBL4426565

SCHEMBL4426565

CC(C)(C(=O)c1ccc(SCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1)N1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.57
MAPK1 P28482 2/20 0.57
ALDH1A1 P00352 2/20 0.57
TSHR P16473 1/20 0.57
HRH3 Q9Y5N1 1/20 0.41
LMNA P02545 1/20 0.37
FKBP1A P62942 4/20 0.36
RAB9A P51151 3/20 0.36
NPC1 O15118 2/20 0.36
TP53 P04637 1/20 0.36
USP2 O75604 1/20 0.36
MAPT P10636 1/20 0.35
MLYCD O95822 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL4422749 1.00 SMN1; SMN2 (0.57) SMN1; SMN2MAPK1ALDH1A1TSHRHRH3
SCHEMBL4421339 1.00 SMN1; SMN2 (0.57) SMN1; SMN2MAPK1ALDH1A1TSHRHRH3
SCHEMBL10883782 0.84 SMN1; SMN2 (0.74) SMN1; SMN2MAPK1ALDH1A1TSHRHRH3
SCHEMBL278825 0.81 SMN1; SMN2 (0.71) SMN1; SMN2MAPK1ALDH1A1TSHRHRH3
SCHEMBL10887683 0.81 SMN1; SMN2 (0.69) SMN1; SMN2MAPK1ALDH1A1TSHRHRH3
SCHEMBL727028 0.81 SMN1; SMN2 (0.69) SMN1; SMN2MAPK1ALDH1A1TSHRHRH3
SCHEMBL17324198 0.81 SMN1; SMN2 (0.69) SMN1; SMN2MAPK1ALDH1A1TSHRHRH3
SCHEMBL8175957 0.79 SMN1; SMN2 (0.67) SMN1; SMN2MAPK1ALDH1A1TSHRHRH3
SCHEMBL10890284 0.79 SMN1; SMN2 (0.67) SMN1; SMN2MAPK1ALDH1A1TSHRHRH3
SCHEMBL6025514 0.79 SMN1; SMN2 (0.67) SMN1; SMN2MAPK1ALDH1A1TSHRHRH3

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
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