SCHEMBL5279754

SCHEMBL5279754

CCC(=O)N(SC)c1ccccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.41
POLQ O75417 1/20 0.40
POLB P06746 1/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
THRB P10828 1/20 0.36
RAB9A P51151 1/20 0.36
NOX1 Q9Y5S8 1/20 0.36
CACNA1C Q13936 1/20 0.36
ACHE P22303 2/20 0.36
BCHE P06276 1/20 0.36
HDAC6 Q9UBN7 2/20 0.35
NOS3 P29474 2/20 0.35
NOS1 P29475 2/20 0.35
NOS2 P35228 2/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL13041529 0.80 POLQ (0.50) ESR1POLQPOLBMAPK1KMT2A
SCHEMBL13041505 0.73 POLQ (0.47) ESR1POLQPOLBMAPK1KMT2A
SCHEMBL3399062 0.71 POLQ (0.48) ESR1POLQPOLBMAPK1KMT2A
SCHEMBL11309832 0.70 POLQ (0.50) ESR1POLQACHEHDAC6LMNA
SCHEMBL3266697 0.69 POLQ (0.46) ESR1POLQALDH1A1ACHEHDAC6
SCHEMBL1652095 0.68 GAA (0.52) ESR1POLQPOLBMAPK1KMT2A
SCHEMBL9821084 0.68 ALDH1A1 (0.44) ESR1POLQPOLBKMT2AKDM4E
SCHEMBL25076165 0.67 TSPO (0.47) ESR1POLQHDAC6LMNAGAA
SCHEMBL5839377 0.67 ESR1 (0.43) ESR1POLQMAPK1HDAC6NOS3
Hydrochloric Acid SCHEMBL5718674 0.67 ESR1 (0.43) ESR1POLQPOLBMAPK1KMT2A

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-1853352-A2 USE OF 3-SULFANYLPROPANAMIDE DERIVATIVES FOR STIMULATING HAIR AND EYELASH GROWTH AND/OR FOR STOPPING THE LOSS AND/OR LIMITING THE DEPIGMENTATION THEREOF L'Oréal (FR) 2007-11-14 EP disclosed
WO-2006079568-A2 USE OF 3-SULFANYLPROPANAMIDE DERIVATIVES FOR STIMULATING HAIR AND EYELASH GROWTH AND/OR FOR STOPPING THE LOSS AND/OR LIMITING THE DEPIGMENTATION THEREOF L'OREAL (FR) 2006-08-03 WO disclosed