SCHEMBL3610348

SCHEMBL3610348

Cc1cc(NC(=O)C2c3cc(CN(C)CCF)ccc3CCN2C(=O)C(C)(C)C)c(C)c(C)c1O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 7/20 0.33
XIAP P98170 4/20 0.32
F11 P03951 2/20 0.31
RORC P51449 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL3603775 0.94 GHSR (0.33) GHSRXIAPF11MEN1KMT2A
Hydrochloric Acid SCHEMBL3608122 0.91 GHSR (0.32) GHSRXIAPF11MEN1KMT2A
SCHEMBL3614774 0.89 GHSR (0.35) GHSRXIAPF11MEN1KMT2A
SCHEMBL3612231 0.87 F11 (0.31) XIAPF11MEN1KMT2A
Hydrochloric Acid SCHEMBL3605870 0.87 GHSR (0.35) GHSRF11
Hydrochloric Acid SCHEMBL3613020 0.86 CYP2D6 (0.32) F11
SCHEMBL3613400 0.85 CYP2D6 (0.31) GHSRXIAPF11
Hydrochloric Acid SCHEMBL3606869 0.84 GHSR (0.35) GHSRF11MEN1KMT2A
SCHEMBL3602396 0.84 F11 (0.33) GHSRXIAPF11MEN1KMT2A
Hydrochloric Acid SCHEMBL3612050 0.84 CYP2D6 (0.33) GHSRXIAPF11

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-20100022582-A1 Tetrahydroisoquinoline Compound and Medicinal Use Thereof KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2010-01-28 US claimed
EP-1857444-A1 TETRAHYDROISOQUINOLINE COMPOUND AND MEDICINAL USE THEREOF Kyoto Pharmaceutical Industries, Ltd. (JP) 2007-11-21 EP claimed
US-20100022582-A1 Tetrahydroisoquinoline Compound and Medicinal Use Thereof KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2010-01-28 US disclosed
EP-1857444-A1 TETRAHYDROISOQUINOLINE COMPOUND AND MEDICINAL USE THEREOF Kyoto Pharmaceutical Industries, Ltd. (JP) 2007-11-21 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-20100022582-A1 Tetrahydroisoquinoline Compound and Medicinal Use Thereof ACAT1, ACAT2, LCAT GHSR 4556/4885XIAP 934/4885F11 4805/4885

“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.