SCHEMBL29438286

SCHEMBL29438286

CN(C)c1c(C(=O)N[C@H]2CCOc3ccccc32)cnc2c(-c3cc(Cl)cc(Cl)c3)cncc12

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 10/20 0.37
▸ BRD4 O60885 2/20 0.37
▸ CREBBP Q92793 2/20 0.37
▸ TRPV1 Q8NER1 1/20 0.36
▸ P2RX7 Q99572 3/20 0.34
▸ SSTR2 P30874 1/20 0.34
▸ KCNH2 Q12809 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
SCHEMBL20600351 1.00 MAPK1 (0.37) MAPK1BRD4CREBBPTRPV1P2RX7
SCHEMBL29900348 0.91 BRD4 (0.40) MAPK1BRD4CREBBPTRPV1P2RX7
SCHEMBL21101078 0.91 BRD4 (0.40) MAPK1BRD4CREBBPTRPV1P2RX7
SCHEMBL21074853 0.91 BRD4 (0.40) MAPK1BRD4CREBBPTRPV1P2RX7
SCHEMBL30853499 0.91 BRD4 (0.40) MAPK1BRD4CREBBPTRPV1P2RX7
SCHEMBL22488629 0.91 BRD4 (0.40) MAPK1BRD4CREBBPTRPV1P2RX7
SCHEMBL22138895 0.89 BRD4 (0.39) MAPK1BRD4CREBBPTRPV1P2RX7
SCHEMBL29438321 0.89 BRD4 (0.39) MAPK1BRD4CREBBPTRPV1P2RX7
SCHEMBL22120512 0.89 BRD4 (0.39) MAPK1BRD4CREBBPTRPV1P2RX7
SCHEMBL20600363 0.89 MAPK1 (0.40) MAPK1BRD4CREBBPTRPV1P2RX7

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 MAPK1 3920/4885BRD4 125/4885CREBBP 3338/4885

“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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