SCHEMBL92931

SCHEMBL92931

BN1CCCC[C@H]1CC(=C)OC

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 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
SCHEMBL92937 0.79 EPHX2 (0.36) —
SCHEMBL3032831 0.76 L3MBTL1 (0.39) KMT2A
SCHEMBL13968227 0.74 FFAR1 (0.38) —
SCHEMBL80871 0.70 KDM1A (0.43) —
SCHEMBL92929 0.68 POLB (0.32) —
SCHEMBL8374646 0.67 POLB (0.32) —
SCHEMBL20794632 0.66 OPRD1 (0.43) —
SCHEMBL13361648 0.66 LMNA (0.36) KMT2A
SCHEMBL11990427 0.66 — —
SCHEMBL19922063 0.64 CHRNB2 (0.44) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129384-B2 Imidazo[1,2-a]pyrazines as orexin receptor antagonists GLAXO GROUP LIMITED (GB) 2012-03-06 — — US disclosed
US-20110288098-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED 2011-11-24 — — US disclosed
US-20100267730-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-10-21 — — US disclosed
US-20100160345-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-06-24 — — US disclosed
US-20090022670-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-01-22 — — 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 (4 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-20110288098-A1 NOVEL COMPOUNDS BRD4, HDAC6, ITPR3 KMT2A 3199/4885
US-20090022670-A1 NOVEL COMPOUNDS UGT1A1, UGT2B7, ABCB1 KMT2A 3634/4885
US-20100267730-A1 NOVEL COMPOUNDS BRD4, DPP4, ITPR3 KMT2A 3658/4885
US-20100160345-A1 NOVEL COMPOUNDS BRD4, HDAC6, ITPR3 KMT2A 3199/4885

“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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