SCHEMBL7312706

SCHEMBL7312706

C[N]S(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 3/20 0.61
PRSS1 P07477 3/20 0.61
PRSS2 P07478 3/20 0.61
PRSS3 P35030 3/20 0.61
LMNA P02545 3/20 0.57
L3MBTL1 Q9Y468 2/20 0.56
ATM Q13315 1/20 0.47
PKM P14618 2/20 0.46
MCOLN3 Q8TDD5 3/20 0.46
TSHR P16473 2/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
PKLR P30613 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL6926772 0.83 F2 (0.65) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL2874475 0.79 F2 (0.56) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL7835980 0.77 F2 (0.57) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL29391838 0.77 LMNA (0.63) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL25642 0.77 LMNA (0.63) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL758323 0.77 ATM (0.66) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL1952494 0.76 LMNA (0.68) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL30286769 0.76 F2 (0.56) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL875072 0.76 F2 (0.56) F2PRSS1PRSS2PRSS3LMNA
SCHEMBL27629181 0.75 LMNA (0.61) F2PRSS1PRSS2PRSS3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020128208-A1 Nonpeptide agonists and antagonists of vasopressin receptors EMORY UNIVERSITY 2002-09-12 US disclosed
WO-2002047679-A2 NONPEPTIDE AGONISTS AND ANTAGONISTS OF VASOPRESSIN RECEPTORS EMORY UNIVERSITY (US) 2002-06-20 WO disclosed
US-5614519-A (1-(2,3 or 4-N-morpholinoalkyl)-imidazol-4-yl)-benizimidazol-1-yl-methyl]-biphenyls useful as angiotensin-II antagonists KARL THOMAE GMBH (DE) 1997-03-25 US disclosed
US-5602127-A ADMINISTERING TO TREAT HYPERTENSION KARL THOMAE GMBH (DE) 1997-02-11 US disclosed
US-5594003-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-14 US disclosed
US-5591762-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-07 US disclosed
EP-0502314-A1 Benzimidazol, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-09-09 EP 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-20020128208-A1 Nonpeptide agonists and antagonists of vasopressin receptors AVPR1A, AVPR2, AVPR1B F2 614/4885PRSS1 842/4885PRSS2 1400/4885

“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.