SCHEMBL1824079

SCHEMBL1824079

Clc1cc(OCCCN2CCCC2)ccn1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ HRH3 Q9Y5N1 12/20 0.55
▸ ACHE P22303 1/20 0.54
▸ RAD52 P43351 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ MEN1 O00255 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ SIGMAR1 Q99720 1/20 0.52

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
SCHEMBL23976303 0.92 LTA4H (0.57) KDM4EALDH1A1SMN1; SMN2HRH3SIGMAR1
SCHEMBL15260249 0.87 ALDH1A1 (0.57) KDM4EALDH1A1SMN1; SMN2HRH3ACHE
SCHEMBL29615450 0.82 HRH3 (0.54) KDM4EHRH3ACHERAD52L3MBTL1
SCHEMBL22918759 0.82 HRH3 (0.54) KDM4EHRH3ACHERAD52L3MBTL1
SCHEMBL15260226 0.79 KDM4E (0.66) KDM4EALDH1A1MEN1KMT2A
SCHEMBL7564110 0.77 KDM4E (0.82) KDM4EALDH1A1SMN1; SMN2HRH3ACHE
SCHEMBL21004113 0.76 HRH3 (0.84) HRH3ACHERAD52MEN1KMT2A
SCHEMBL21004213 0.75 KDM4E (0.65) KDM4EALDH1A1SMN1; SMN2HRH3ACHE
SCHEMBL3581930 0.75 HRH3 (0.89) HRH3ACHERAD52L3MBTL1
SCHEMBL28285426 0.74 HRH3 (0.88) HRH3ACHERAD52MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2315761-B1 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LTD (GB) 2018-07-11 — — EP disclosed
EP-2315761-B1 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LTD (GB) 2018-07-11 — — EP disclosed
US-8461339-B2 Pharmaceutical compounds SENTINEL ONCOLOGY LIMITED (US) 2013-06-11 — — US disclosed
US-8461339-B2 Pharmaceutical compounds SENTINEL ONCOLOGY LIMITED (US) 2013-06-11 — — US disclosed
US-8461339-B2 Pharmaceutical compounds SENTINEL ONCOLOGY LIMITED (US) 2013-06-11 — — US disclosed
US-20110130394-A1 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LIMITED (GB) 2011-06-02 — — US disclosed
US-20110130394-A1 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LIMITED (GB) 2011-06-02 — — US disclosed
US-20110130394-A1 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LIMITED (GB) 2011-06-02 — — US disclosed
EP-2315761-A1 PHARMACEUTICAL COMPOUNDS Sentinel Oncology Limited (GB) 2011-05-04 — — EP disclosed
WO-2010007374-A1 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LIMITED (GB) 2010-01-21 — — WO disclosed
WO-2010007374-A1 PHARMACEUTICAL COMPOUNDS SENTINEL ONCOLOGY LIMITED (GB) 2010-01-21 — — 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-20110130394-A1 PHARMACEUTICAL COMPOUNDS NR2C2, NR3C2, NR0B2 KDM4E 3351/4885ALDH1A1 4706/4885SMN1; SMN2 2784/4885

“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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