SCHEMBL18483479

SCHEMBL18483479

CC(COC1CCC(C(C)C)CC1)CC1COC1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HCRTR2 O43614 2/20 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
SCHEMBL24462741 0.73 HCRTR2 (0.39) HCRTR2
SCHEMBL20021699 0.73 HCRTR2 (0.39) HCRTR2
SCHEMBL18483615 0.72 HCRTR2 (0.33) HCRTR2
SCHEMBL18507245 0.71 HCRTR2 (0.31) HCRTR2
SCHEMBL23194412 0.70 HCRTR2 (0.35) HCRTR2
SCHEMBL4762344 0.68 HCRTR2 (0.38) HCRTR2
SCHEMBL11991405 0.68 HCRTR2 (0.38) HCRTR2
SCHEMBL20334913 0.68 MEN1 (0.36) —
SCHEMBL10327132 0.67 HCRTR2 (0.41) HCRTR2
SCHEMBL9066827 0.67 HCRTR2 (0.39) HCRTR2

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-20170037032-A1 AMINO PYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS NOVARTIS AG (CH) 2017-02-09 — — 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-20170037032-A1 AMINO PYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS PI4KA, PIP4K2B, PHKG1 HCRTR2 4844/4885

“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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