SCHEMBL29964954

SCHEMBL29964954

COc1ncc(-c2cccc(Cl)c2Cl)c2ncc(C(=O)N[C@H]3CCOc4ccccc43)c(N3CCOCC3)c12

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 4/20 0.38
▸ CNR2 P34972 5/20 0.36
▸ BRD4 O60885 2/20 0.35
▸ CREBBP Q92793 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ P2RX7 Q99572 3/20 0.34
▸ CNR1 P21554 1/20 0.34
▸ WDR5 P61964 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ PKM P14618 1/20 0.33

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
SCHEMBL29438330 1.00 MAPK1 (0.38) MAPK1CNR2BRD4CREBBPLMNA
SCHEMBL21875761 1.00 MAPK1 (0.38) MAPK1CNR2BRD4CREBBPLMNA
SCHEMBL20621761 0.89 KDM4C (0.37) CNR2LMNATP53P2RX7PKM
SCHEMBL21875787 0.88 MAPK1 (0.41) MAPK1CNR2BRD4CREBBPLMNA
SCHEMBL29438302 0.88 MAPK1 (0.41) MAPK1CNR2BRD4CREBBPLMNA
SCHEMBL29964976 0.88 MAPK1 (0.41) MAPK1CNR2BRD4CREBBPLMNA
SCHEMBL21875780 0.88 MAPK1 (0.40) MAPK1CNR2BRD4CREBBPLMNA
SCHEMBL29438298 0.88 MAPK1 (0.40) MAPK1CNR2BRD4CREBBPLMNA
SCHEMBL29964854 0.88 MAPK1 (0.40) MAPK1CNR2BRD4CREBBPLMNA
SCHEMBL21875807 0.87 MAPK1 (0.40) MAPK1BRD4CREBBPP2RX7

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-11485733-B2 Azaquinoline derivatives BAYER ANIMAL HEALTH GMBH (DE) 2022-11-01 — — 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-11485733-B2 Azaquinoline derivatives RECQL, H1-5, H1-3 MAPK1 4432/4885CNR2 804/4885BRD4 1125/4885

“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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