SCHEMBL10073578

SCHEMBL10073578

COc1ccc2c(c1OCc1ccccc1)C[C@@H](C)N(C(=O)C(c1ccccc1)c1ccccc1)C2

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 19/20 0.81
AGTR1 P30556 2/20 0.81

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
Olodanrigan SCHEMBL8964136 0.90 AGTR2 (1.00) AGTR2AGTR1
Olodanrigan SCHEMBL421411 0.90 AGTR2 (1.00) AGTR2AGTR1
Olodanrigan SCHEMBL244657 0.90 AGTR2 (1.00) AGTR2AGTR1
Olodanrigan SCHEMBL29394365 0.90 AGTR2 (1.00) AGTR2AGTR1
SCHEMBL3516610 0.89 AGTR2 (0.88) AGTR2AGTR1
SCHEMBL10047781 0.88 AGTR2 (0.64) AGTR2AGTR1
SCHEMBL17180701 0.88 AGTR2 (0.77) AGTR2AGTR1
SCHEMBL17180727 0.88 AGTR2 (0.77) AGTR2AGTR1
SCHEMBL10073581 0.88 AGTR2 (0.66) AGTR2AGTR1
SCHEMBL3513547 0.86 AGTR2 (0.83) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120022101-A1 SALT AND SOLVATES OF A TETRAHYDROISOQUINOLINE DERIVATIVE SPINIFEX PHARMACEUTICALS PTY LTD, (AU) 2012-01-26 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-20120022101-A1 SALT AND SOLVATES OF A TETRAHYDROISOQUINOLINE DERIVATIVE REN, SUDS3, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 AGTR2 75/4885AGTR1 97/4885

“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.