SCHEMBL6529410

SCHEMBL6529410

c1ccc(CSn2cnc3ccccc32)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 6/20 0.53
▸ CYP11B2 P19099 6/20 0.53
▸ TNF P01375 1/20 0.53
▸ HTT P42858 5/20 0.50
▸ ASAH1 Q13510 2/20 0.47
▸ TDP1 Q9NUW8 1/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.45
▸ LMNA P02545 3/20 0.45
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ MAPK1 P28482 1/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ LTA4H P09960 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ EGLN3 Q9H6Z9 1/20 0.41

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
SCHEMBL8413080 0.82 TDP1 (0.48) CYP11B1CYP11B2TNFHTTASAH1
SCHEMBL599672 0.79 POLB (0.45) CYP11B1CYP11B2TNFHTTTDP1
SCHEMBL9060998 0.79 TDP1 (0.48) CYP11B1CYP11B2TNFHTTASAH1
SCHEMBL10873867 0.78 KCNMA1 (0.43) CYP11B1CYP11B2TNFHTTASAH1
SCHEMBL8555984 0.76 PKM (0.61) HTTSMN1; SMN2LMNAALDH1A1
SCHEMBL8792548 0.76 TDP1 (0.46) CYP11B1CYP11B2TNFHTTASAH1
SCHEMBL11451311 0.76 TDP1 (0.46) CYP11B1CYP11B2TNFHTTTDP1
SCHEMBL6530090 0.76 TDP1 (0.46) CYP11B1CYP11B2TNFHTTTDP1
SCHEMBL20683088 0.76 TDP1 (0.48) CYP11B1CYP11B2TNFHTTASAH1
SCHEMBL8013907 0.75 TDP1 (0.52) CYP11B1CYP11B2TNFHTTTDP1

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-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
WO-1995029897-A1 METHOD OF USING (H+/K+) ATPase INHIBITORS AS ANTIVIRAL AGENTS G.D. SEARLE & CO. (US) 1995-11-09 — — WO disclosed
US-4873346-A BRONCHODILATORS, TREATMENT OF ASTHMA THE UPJOHN COMPANY (US) 1989-10-10 — — 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 CYP11B1 2831/4885CYP11B2 3447/4885TNF 4056/4885

“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.

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