SCHEMBL19269229

SCHEMBL19269229

Cc1cc(-c2cc(-c3cncnc3)cc(-c3cncnc3)c2)ccc1-n1c2ccccc2c2cc(N(c3ccccc3)c3ccccc3)ccc21

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 3/20 0.32
▸ ICMT O60725 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ TSPO P30536 1/20 0.32
▸ BRD4 O60885 1/20 0.31
▸ ATM Q13315 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
SCHEMBL19269223 1.00 NPY5R (0.32) NPY5RICMTTP53TSPOBRD4
SCHEMBL19269236 0.98 NPY5R (0.33) NPY5RICMTTP53TSPOBRD4
SCHEMBL20413208 0.97 TSPO (0.33) NPY5RICMTTP53TSPOBRD4
SCHEMBL19269228 0.97 TSPO (0.34) NPY5RICMTTP53TSPOBRD4
SCHEMBL19269924 0.95 ICMT (0.35) ICMTTP53BRD4ATM
SCHEMBL19270765 0.94 ATM (0.36) ICMTTP53BRD4ATM
SCHEMBL19268561 0.89 ATM (0.33) NPY5RICMTATM
SCHEMBL19270046 0.88 ATM (0.33) NPY5RICMTTSPOATM
SCHEMBL19269233 0.88 ATM (0.35) NPY5RICMTTSPOBRD4ATM
SCHEMBL19269234 0.87 ATM (0.34) NPY5RICMTTSPOATM

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-20170244049-A1 ORGANIC LIGHT-EMITTING DIODE MATERIALS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-08-24 — — 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 (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-20170244049-A1 ORGANIC LIGHT-EMITTING DIODE MATERIALS CYBA, DDT, DRD1 NPY5R 4611/4885ICMT 86/4885TP53 3325/4885

“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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