SCHEMBL3110788

SCHEMBL3110788

O=c1ccsn1-c1cccc(C(F)(F)F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 5/20 0.56
EP300 Q09472 3/20 0.56
PMM2 O15305 1/20 0.54
MPI P34949 1/20 0.54
PHOSPHO1 Q8TCT1 1/20 0.54
PIN1 Q13526 1/20 0.49
RGS4 P49798 2/20 0.48
RGS8 P57771 2/20 0.48
HTT P42858 1/20 0.47
ALKBH5 Q6P6C2 1/20 0.46
AR P10275 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 2/20 0.44
ALOX5 P09917 1/20 0.43
CYP1A2 P05177 1/20 0.43
HTR3E A5X5Y0 1/20 0.43
HTR3B O95264 1/20 0.43
HTR1D P28221 1/20 0.43
HTR2C P28335 1/20 0.43

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
SCHEMBL9132193 0.76 KAT2B (0.63) KAT2BEP300PMM2MPIPHOSPHO1
SCHEMBL22657 0.73 KAT2B (1.00) KAT2BEP300PMM2MPIPHOSPHO1
SCHEMBL17537376 0.72 CYP1A2 (0.58) PMM2MPIPHOSPHO1HTTALKBH5
SCHEMBL17459260 0.71 CYP1A2 (0.50) PMM2MPIPHOSPHO1HTTALKBH5
SCHEMBL30613483 0.70 HTT (0.56) PMM2MPIPHOSPHO1HTTALKBH5
SCHEMBL2537991 0.70 MPI (1.00) PMM2MPIPHOSPHO1ALDH1A1
SCHEMBL3180022 0.69 MGLL (0.64) HTTARMEN1KMT2AALDH1A1
SCHEMBL1728312 0.69 CYP1A2 (0.51) PMM2MPIPHOSPHO1HTTAR
SCHEMBL4860704 0.69 HTT (0.55) PMM2MPIPHOSPHO1HTTALKBH5
SCHEMBL10714874 0.69 CYP1A2 (0.51) PMM2MPIPHOSPHO1HTTAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1401379-B1 REDUCTION OF HAIR GROWTH GILLETTE CO (US) 2010-04-07 EP claimed
US-7439271-B2 Reduction of hair growth THE GILLETTE COMPANY (US) 2008-10-21 US claimed
EP-1401379-A2 REDUCTION OF HAIR GROWTH THE GILLETTE COMPANY (US) 2004-03-31 EP claimed
US-20030012755-A1 Reduction of hair growth GILLETTE COMPANY, THE 2003-01-16 US claimed
WO-2003002077-A2 REDUCTION OF HAIR GROWTH THE GILLETTE COMPANY (US) 2003-01-09 WO claimed
EP-1401379-B1 REDUCTION OF HAIR GROWTH GILLETTE CO (US) 2010-04-07 EP disclosed
US-7439271-B2 Reduction of hair growth THE GILLETTE COMPANY (US) 2008-10-21 US disclosed
EP-1401379-A2 REDUCTION OF HAIR GROWTH THE GILLETTE COMPANY (US) 2004-03-31 EP disclosed
US-20030012755-A1 Reduction of hair growth GILLETTE COMPANY, THE 2003-01-16 US disclosed
WO-2003002077-A2 REDUCTION OF HAIR GROWTH THE GILLETTE COMPANY (US) 2003-01-09 WO disclosed