SCHEMBL1853562

SCHEMBL1853562

CCCCCCCCCCCCNS(=O)(=O)c1ccc(C[N]Cc2ccc(C(F)(F)F)cc2)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
TSHR P16473 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HTT P42858 2/20 0.50
MEN1 O00255 2/20 0.50
RECQL P46063 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 3/20 0.36
TP53 P04637 2/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
EPHX1 P07099 1/20 0.36
CA12 O43570 2/20 0.35
CA9 Q16790 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 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
SCHEMBL4714646 0.89 TSHR (0.47) KMT2ATSHRSMN1; SMN2HTTMEN1
SCHEMBL4717987 0.89 TSHR (0.47) KMT2ATSHRSMN1; SMN2HTTMEN1
SCHEMBL4714622 0.87 TSHR (0.56) KMT2ATSHRSMN1; SMN2HTTMEN1
SCHEMBL4711870 0.85 HTT (0.52) KMT2ATSHRSMN1; SMN2HTTMEN1
SCHEMBL1852234 0.84 HTT (0.51) KMT2ATSHRSMN1; SMN2HTTMEN1
SCHEMBL4019037 0.84 HTT (0.51) KMT2ATSHRSMN1; SMN2HTTMEN1
SCHEMBL4025020 0.82 TSHR (0.49) KMT2ATSHRSMN1; SMN2HTTMEN1
SCHEMBL4017087 0.80 KMT2A (0.51) KMT2ATSHRSMN1; SMN2HTTMEN1
SCHEMBL1853297 0.79 SMN1; SMN2 (0.45) KMT2ATSHRSMN1; SMN2HTTMEN1
SCHEMBL4714867 0.78 KMT2A (0.49) KMT2ATSHRSMN1; SMN2HTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1986637-A1 SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS Laboratoires Serono SA (CH) 2008-11-05 EP claimed
WO-2007093557-A1 SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS LABORATOIRES SERONO S.A. (CH) 2007-08-23 WO claimed
EP-1470102-A1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) Applied Research Systems ARS Holding N.V. (AN) 2004-10-27 EP claimed
WO-2003064376-A1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2003-08-07 WO claimed
EP-1470102-B1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) MERCK SERONO SA (CH) 2011-05-25 EP disclosed