SCHEMBL3367135

SCHEMBL3367135

CN(c1ccc(OCCCCCCN2CCCCC2)cc1)S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 16/20 0.66
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
KCNH2 Q12809 2/20 0.58
PSEN1 P49768 1/20 0.52
PSEN2 P49810 1/20 0.52
APH1B Q8WW43 1/20 0.52
NCSTN Q92542 1/20 0.52
APH1A Q96BI3 1/20 0.52
PSENEN Q9NZ42 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
SCHEMBL3365222 1.00 HRH3 (0.66) HRH3MEN1KMT2AKCNH2PSEN1
SCHEMBL3362441 0.99 HRH3 (0.64) HRH3MEN1KMT2AKCNH2PSEN1
SCHEMBL3368422 0.92 HRH3 (0.53) HRH3
SCHEMBL3369182 0.90 HRH3 (0.51) HRH3
SCHEMBL3365072 0.90 HRH3 (0.55) HRH3MEN1KMT2A
SCHEMBL3365566 0.89 HRH3 (0.66) HRH3MEN1KMT2AKCNH2PSEN1
SCHEMBL3366845 0.89 ATM (0.64) HRH3KCNH2PSEN1PSEN2APH1B
SCHEMBL3368715 0.89 HRH3 (0.66) HRH3MEN1KMT2AKCNH2PSEN1
SCHEMBL3368538 0.89 ATM (0.64) HRH3KCNH2PSEN1PSEN2APH1B
SCHEMBL3366911 0.88 PGR (0.51) HRH3

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-1303503-B1 ANILINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-01-27 EP disclosed
US-6683201-B2 FOR THERAPY AND PROPHYLAXIS OF HYPERCHOLESTEROLEMIA, HYPERLIPEMIA, ARTERIOSCLEROSIS, VASCULAR DISEASES, MYCOSES, PARASITE INFECTIONS, GALLSTONES, TUMORS AND/OR HYPERPROLIFERATIVE DISORDERS, DIABETES HOFFMANN-LA ROCHE INC. 2004-01-27 US disclosed
CN-1443179-A Aniline derivatives HOFFMANN LA ROCHE (CH) 2003-09-17 CN disclosed
EP-1303503-A2 ANILINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-04-23 EP disclosed
US-20020038025-A1 Analine derivatives as OSC inhibitors F.HOFFMANN-LA ROCHE AG (CH) 2002-03-28 US disclosed
WO-2002006189-A2 ANILINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-01-24 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-20020038025-A1 Analine derivatives as OSC inhibitors LSS, CYP51A1, CYP46A1 HRH3 3372/4885MEN1 615/4885KMT2A 3898/4885

“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.