SCHEMBL9049092

SCHEMBL9049092

Nc1ncc([S+]([O-])c2ccc(C(F)(F)F)cn2)s1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
EPHX2 P34913 1/20 0.34
SCN4A P35499 1/20 0.34
PTGS1 P23219 1/20 0.33
ALDH1A1 P00352 1/20 0.32
RECQL P46063 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ABL1 P00519 1/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 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
SCHEMBL9099497 0.74 NOS1 (0.44) EPHX2ALDH1A1RECQL
SCHEMBL8940793 0.73 NOS1 (0.34) ALDH1A1KDM4E
SCHEMBL9097546 0.69 NCF1 (0.39) KMT2AALDH1A1KDM4EMEN1
SCHEMBL9046922 0.68 NOS1 (0.36) ALDH1A1
SCHEMBL9099459 0.68 BACE1 (0.44) KMT2AALDH1A1KDM4ELMNAMEN1
SCHEMBL9426491 0.67 ADORA3 (0.44) EPHX2ALDH1A1
SCHEMBL9097235 0.67 KDM4E (0.37) KMT2AALDH1A1KDM4ELMNAMEN1
SCHEMBL9098537 0.67 ALDH1A1 (0.35) ALDH1A1KDM4ELMNA
SCHEMBL9047243 0.66 NOS1 (0.34) KMT2AEPHX2ALDH1A1RECQLKDM4E
SCHEMBL9098247 0.66 ADORA3 (0.36) KMT2AEPHX2ALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0412404-B1 Thiazole derivatives, processes for production thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1996-01-31 EP disclosed
US-5369107-A Thiazole derivatives, processes for production thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-29 US disclosed
US-5256675-A Antirheumatic agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-10-26 US disclosed
EP-0412404-A2 Thiazole derivatives, processes for production thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-02-13 EP disclosed