SCHEMBL6482247

SCHEMBL6482247

c1ccc(CSc2ccc(SCc3ccccc3)nc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.49
HSD17B10 Q99714 1/20 0.48
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
MEN1 O00255 1/20 0.47
NFKB1 P19838 1/20 0.47
HTT P42858 1/20 0.47
NFKB2 Q00653 1/20 0.47
KMT2A Q03164 1/20 0.47
RELA Q04206 1/20 0.47
MAOA P21397 3/20 0.47
MAOB P27338 3/20 0.47
CXCR2 P25025 1/20 0.47
SCN9A Q15858 1/20 0.47
ABL1 P00519 1/20 0.45
RIN1 Q13671 1/20 0.45
MAPT P10636 2/20 0.44
GAA P10253 1/20 0.44
POLB P06746 2/20 0.44

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
SCHEMBL30902133 0.80 CXCR2 (0.59) L3MBTL1HSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL18059460 0.80 L3MBTL1 (0.48) L3MBTL1HSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL16011599 0.80 L3MBTL1 (0.50) L3MBTL1HSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL2995142 0.80 L3MBTL1 (0.48) L3MBTL1HSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL19859227 0.80 SCN9A (0.49) HSD17B10NPC1RAB9ASMN1; SMN2HTT
SCHEMBL11973215 0.80 L3MBTL1 (0.48) L3MBTL1HSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL15359704 0.80 L3MBTL1 (0.48) L3MBTL1HSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL19970154 0.80 SMN1; SMN2 (0.50) HSD17B10NPC1RAB9ASMN1; SMN2MAOA
SCHEMBL2887792 0.80 SCN9A (0.52) HSD17B10RAB9AMEN1HTTKMT2A
SCHEMBL30553438 0.80 L3MBTL1 (0.48) L3MBTL1HSD17B10NPC1RAB9ASMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4616087-A ANTIVIRAL ACTIVITY THE DOW CHEMICAL COMPANY (US) 1986-10-07 US claimed
US-6906078-B2 Method of using (H+/K+) ATPase inhibitors as antiviral agents PHARMACIA CORPORATION (US) 2005-06-14 US disclosed
US-20010047038-A1 Method of using (H+/K+) ATPase inhibitors as antiviral agents MOORMAN ALAN E (US) 2001-11-29 US disclosed
US-5945425-A ADENOSINE TRIPHOSPHASE INHIBITOR; DNA VIRICIDE G.D. SEARLE & CO. (US) 1999-08-31 US disclosed
US-4616087-A ANTIVIRAL ACTIVITY THE DOW CHEMICAL COMPANY (US) 1986-10-07 US disclosed
US-4371537-A Sulfur-substituted phenoxypyridines having antiviral activity THE DOW CHEMICAL COMPANY (US) 1983-02-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010047038-A1 Method of using (H+/K+) ATPase inhibitors as antiviral agents ATP4A, ATP1A1, ATP1A4 L3MBTL1 4324/4885HSD17B10 954/4885NPC1 363/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.