SCHEMBL29438262

SCHEMBL29438262

O=C(N[C@H]1CCOc2ccccc21)c1cnc2c(-c3cccc(Cl)c3Cl)nccc2c1N1CCOCC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 3/20 0.38
▸ CNR2 P34972 7/20 0.37
▸ CNR1 P21554 1/20 0.37
▸ PKM P14618 1/20 0.36
▸ MAPK1 P28482 3/20 0.36
▸ TRPV1 Q8NER1 1/20 0.35
▸ BRD4 O60885 2/20 0.35
▸ CREBBP Q92793 2/20 0.35
▸ KMT2A Q03164 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34

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
SCHEMBL21875798 1.00 P2RX7 (0.38) P2RX7CNR2CNR1PKMMAPK1
SCHEMBL20621805 1.00 P2RX7 (0.38) P2RX7CNR2CNR1PKMMAPK1
SCHEMBL29438318 0.91 MEN1 (0.37) P2RX7CNR2CNR1PKMMAPK1
SCHEMBL21875783 0.91 MEN1 (0.37) P2RX7CNR2CNR1PKMMAPK1
SCHEMBL30071194 0.91 CNR2 (0.39) P2RX7CNR2CNR1PKMMAPK1
SCHEMBL20154267 0.91 CNR2 (0.39) P2RX7CNR2CNR1PKMMAPK1
SCHEMBL20143007 0.91 CNR2 (0.39) P2RX7CNR2CNR1PKMMAPK1
SCHEMBL20600069 0.88 P2RX7 (0.39) P2RX7CNR2CNR1MAPK1TRPV1
SCHEMBL29438334 0.88 P2RX7 (0.39) P2RX7CNR2CNR1MAPK1TRPV1
SCHEMBL20600383 0.87 CNR2 (0.38) P2RX7CNR2CNR1PKMTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220064160-A1 BICYCLIC DERIVATIVES ELANCO TIERGESUNDHEIT AG (US) 2022-03-03 — — US claimed
CN-110770227-B Novel azaquinoline derivatives 拜耳动物保健有限责任公司 2024-03-01 — — CN disclosed
US-20220064160-A1 BICYCLIC DERIVATIVES ELANCO TIERGESUNDHEIT AG (US) 2022-03-03 — — 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-20220064160-A1 BICYCLIC DERIVATIVES FABP3, CYCS, PIGS P2RX7 803/4885CNR2 878/4885CNR1 1030/4885

“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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