SCHEMBL7602816

SCHEMBL7602816

CSC(=S)c1nc2ccccc2s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.59
NPC1 O15118 9/20 0.59
KMT2A Q03164 7/20 0.59
MAPT P10636 7/20 0.59
SMN1; SMN2 Q16637 7/20 0.59
MEN1 O00255 6/20 0.59
LMNA P02545 3/20 0.59
MAPK1 P28482 2/20 0.59
L3MBTL1 Q9Y468 6/20 0.57
TDP1 Q9NUW8 5/20 0.57
CYP1A2 P05177 2/20 0.57
CYP3A4 P08684 2/20 0.57
CYP2C19 P33261 2/20 0.57
CYP2C9 P11712 1/20 0.57
KCNH2 Q12809 1/20 0.57
ALDH1A1 P00352 7/20 0.54
THRB P10828 1/20 0.53
RECQL P46063 1/20 0.53
NFKB1 P19838 3/20 0.51
NFKB2 Q00653 3/20 0.51

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
SCHEMBL8031188 0.79 RAB9A (0.65) RAB9ANPC1KMT2AMAPTSMN1; SMN2
SCHEMBL17153866 0.78 RAB9A (0.58) RAB9ANPC1KMT2AMAPTSMN1; SMN2
Ammonia Solution, Strong SCHEMBL10619764 0.78 RAB9A (0.63) RAB9ANPC1KMT2AMAPTSMN1; SMN2
Ammonia Solution, Strong SCHEMBL10619768 0.78 RAB9A (0.63) RAB9ANPC1KMT2AMAPTSMN1; SMN2
Zinc Ion SCHEMBL11742498 0.76 RAB9A (0.57) RAB9ANPC1KMT2AMAPTSMN1; SMN2
SCHEMBL8977714 0.75 MAPT (0.67) RAB9ANPC1KMT2AMAPTSMN1; SMN2
SCHEMBL569032 0.74 ALDH1A1 (0.67) RAB9ANPC1KMT2AMAPTSMN1; SMN2
SCHEMBL21865146 0.74 THRB (0.65) RAB9ANPC1KMT2AMAPTSMN1; SMN2
SCHEMBL21023359 0.74 ALDH1A1 (0.57) RAB9ANPC1KMT2AMAPTSMN1; SMN2
SCHEMBL12545749 0.74 RECQL (0.65) RAB9ANPC1KMT2AMAPTSMN1; SMN2

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
US-6372297-B1 TREATING THE WOOD OR THE COMPOSITE WOOD MATERIAL WITH A FUNGICIDE OR BACTERICIDE COMPOUND 3-ARYL-5,6-DIHYDRO-1,4,2-OXATHIAZINES AND THEIR OXIDES UNIROYAL CHEMICAL COMPANY, INC. 2002-04-16 US disclosed
US-5777110-A FUNGICIDES OR BACTERICIDES FOR WOOD UNIROYAL CHEMICAL COMPANY, INC. (US) 1998-07-07 US disclosed
EP-0715625-B1 WOOD PRESERVATIVE OXATHIAZINES UNIROYAL CHEM CO INC (US) 1997-06-04 EP disclosed
EP-0715625-A1 WOOD PRESERVATIVE OXATHIAZINES UNIROYAL CHEM CO INC (US) 1996-06-12 EP disclosed
WO-1995006043-A1 WOOD PRESERVATIVE OXATHIAZINES UNIROYAL CHEMICAL COMPANY, INC. (US) 1995-03-02 WO disclosed