SCHEMBL18984649

SCHEMBL18984649

CN1CCC(NCc2cccc(-c3ccccn3)c2)CC1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAP4K4 O95819 6/20 0.59
▸ CARM1 Q86X55 6/20 0.54
▸ PRMT6 Q96LA8 6/20 0.54
▸ ACHE P22303 1/20 0.46
▸ BACE1 P56817 1/20 0.46
▸ GSK3B P49841 1/20 0.44
▸ DYRK1A Q13627 1/20 0.44
▸ PRMT8 Q9NR22 1/20 0.44
▸ HTR5A P47898 1/20 0.43
▸ HCRTR1 O43613 1/20 0.43
▸ HCRTR2 O43614 1/20 0.43

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
SCHEMBL18129157 0.88 MAP4K4 (0.58) MAP4K4CARM1PRMT6HCRTR1HCRTR2
SCHEMBL18984688 0.86 MAP4K4 (0.56) MAP4K4CARM1PRMT6HCRTR1HCRTR2
SCHEMBL18129094 0.86 MAP4K4 (0.56) MAP4K4CARM1PRMT6HCRTR1HCRTR2
SCHEMBL375149 0.83 MAP4K4 (0.58) MAP4K4CARM1PRMT6
SCHEMBL18129078 0.80 MAP4K4 (0.56) MAP4K4CARM1PRMT6HCRTR1HCRTR2
SCHEMBL8081164 0.76 ACHE (0.68) CARM1PRMT6ACHEBACE1
SCHEMBL15587419 0.75 ACHE (0.71) MAP4K4CARM1PRMT6ACHEBACE1
SCHEMBL13321381 0.75 VCP (0.49) CARM1PRMT6
SCHEMBL18137750 0.75 ACHE (0.52) MAP4K4CARM1PRMT6ACHEBACE1
SCHEMBL15587664 0.75 MAP4K4 (1.00) MAP4K4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9855269-B2 Aminoquinazoline and pyridopyrimidine derivatives GENENTECH, INC. (US) 2018-01-02 — — US disclosed
US-20170173026-A1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES GENENTECH, INC. (US) 2017-06-22 — — 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-20170173026-A1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES FLT4, FLT1, KDR MAP4K4 662/4885CARM1 2613/4885PRMT6 128/4885

“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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