SCHEMBL14854409

SCHEMBL14854409

CCn1cc(CN2CCCCC2)c(=O)c2cc(OCc3ccc(OC)cc3)c(OCc3ccc(OC)cc3)cc21

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 7/20 0.47
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ THRB P10828 1/20 0.41
▸ KCNH2 Q12809 1/20 0.40
▸ MCHR1 Q99705 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL15680395 0.99 HRH3 (0.46) HRH3MEN1KMT2ATHRBKCNH2
SCHEMBL14854446 0.87 HRH3 (0.47) HRH3MEN1KMT2AKCNH2MCHR1
SCHEMBL14854487 0.85 HRH3 (0.45) HRH3MEN1KMT2AKCNH2MCHR1
SCHEMBL14854478 0.85 HRH3 (0.45) HRH3MEN1KMT2AKCNH2MCHR1
SCHEMBL15670875 0.84 HRH3 (0.40) HRH3MEN1KMT2AKCNH2MCHR1
SCHEMBL14854474 0.84 HRH3 (0.44) HRH3MEN1KMT2AKCNH2MCHR1
SCHEMBL14854414 0.83 HRH3 (0.42) HRH3MEN1KMT2AKCNH2MCHR1
SCHEMBL15991230 0.83 HRH3 (0.42) HRH3MEN1KMT2ATHRBKCNH2
SCHEMBL14854397 0.83 HRH3 (0.44) HRH3MEN1KMT2AKCNH2MCHR1
SCHEMBL14854433 0.82 HRH3 (0.44) HRH3MEN1KMT2AKCNH2MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2763539-B1 ANTIBACTERIAL COMPOUNDS GLAXO GROUP LTD (GB) 2017-02-08 — — EP disclosed
US-9340556-B2 Antibacterial compounds GLAXO GROUP LIMITED (GB) 2016-05-17 — — US disclosed
US-9340556-B2 Antibacterial compounds GLAXO GROUP LIMITED (GB) 2016-05-17 — — US disclosed
US-20140249126-A1 ANTIBACTERIAL COMPOUNDS GLAXO GROUP LIMITED (GB) 2014-09-04 — — US disclosed
US-20140249126-A1 ANTIBACTERIAL COMPOUNDS GLAXO GROUP LIMITED (GB) 2014-09-04 — — US disclosed
WO-2013052568-A1 ANTIBACTERIAL COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-04-11 — — WO 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-20140249126-A1 ANTIBACTERIAL COMPOUNDS MRPL21, PEPD, ABCB11 HRH3 3639/4885MEN1 2363/4885KMT2A 4417/4885

“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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