SCHEMBL683361

SCHEMBL683361

CCOC(=O)c1sc(C)c2nc(SCC)n(Cc3ccc(-c4ccccc4-c4noc(=O)[nH]4)cc3)c12

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 1/20 0.49
PPARG P37231 4/20 0.48
KCNH2 Q12809 1/20 0.48
AGTR1 P30556 1/20 0.46

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
SCHEMBL683666 0.94 PPARG (0.50) AGTR2PPARGAGTR1
SCHEMBL683670 0.92 AGTR1 (0.49) PPARGAGTR1
SCHEMBL682534 0.91 AGTR2 (0.62) AGTR2PPARGAGTR1
SCHEMBL684052 0.89 AGTR2 (0.60) AGTR2PPARGKCNH2AGTR1
SCHEMBL7012387 0.82 AGTR1 (0.38) AGTR2PPARGAGTR1
SCHEMBL7016142 0.82 AGTR1 (0.39) AGTR2PPARGAGTR1
SCHEMBL684048 0.82 AGTR2 (0.57) AGTR2PPARGKCNH2AGTR1
SCHEMBL683658 0.80 AGTR2 (0.75) AGTR2PPARGKCNH2AGTR1
SCHEMBL12894783 0.80 AGTR1 (0.50) PPARGAGTR1
SCHEMBL9032973 0.79 AGTR1 (0.41) AGTR2AGTR1

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
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN BRAINCELLS INC. (US) 2011-11-03 US disclosed
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN BRAINCELLS INC. (US) 2011-11-03 US disclosed
US-20110046090-A1 MODULATION OF NEUROGENESIS WITH GABA AGENTS AND GABA ANALOGS BRAINCELLS INC. (US) 2011-02-24 US disclosed
US-20110046090-A1 MODULATION OF NEUROGENESIS WITH GABA AGENTS AND GABA ANALOGS BRAINCELLS INC. (US) 2011-02-24 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 (2 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-20110046090-A1 MODULATION OF NEUROGENESIS WITH GABA AGENTS AND GABA ANALOGS GAP43, GABRB1, GABRB3 AGTR2 2610/4885PPARG 156/4885KCNH2 4093/4885
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN NGF, DCX, BDNF AGTR2 9/4885PPARG 622/4885KCNH2 2626/4885

“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.