SCHEMBL3496263

SCHEMBL3496263

COC(=O)c1cnn(-c2cccc(OC)c2)c1C1CCCCC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 11/20 0.58
NFE2L2 Q16236 11/20 0.58
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPT P10636 1/20 0.46
NSD2 O96028 1/20 0.46
NSD1 Q96L73 1/20 0.46
NSD3 Q9BZ95 1/20 0.46
LPAR5 Q9H1C0 1/20 0.46
HPSE Q9Y251 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
TP53 P04637 1/20 0.46
POLB P06746 1/20 0.46
SPR P35270 1/20 0.46

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
SCHEMBL3495294 0.90 NFE2L2 (0.67) KEAP1NFE2L2NSD2NSD1NSD3
SCHEMBL3494173 0.88 KEAP1 (0.52) KEAP1NFE2L2MEN1KMT2ATP53
SCHEMBL18733521 0.88 NFE2L2 (0.57) KEAP1NFE2L2SPR
SCHEMBL3494108 0.87 KEAP1 (0.64) KEAP1NFE2L2KMT2AMAPTTP53
SCHEMBL3493401 0.83 KEAP1 (0.48) KEAP1NFE2L2MEN1KMT2AMAPT
SCHEMBL18707107 0.82 NFE2L2 (0.53) KEAP1NFE2L2TP53POLBSPR
SCHEMBL13848786 0.81 KEAP1 (0.72) KEAP1NFE2L2KMT2AMAPTTP53
SCHEMBL18700800 0.79 NFE2L2 (0.52) KEAP1NFE2L2MEN1KMT2AMAPT
SCHEMBL18700882 0.78 NFE2L2 (0.68) KEAP1NFE2L2MAPTTP53SPR
SCHEMBL18700747 0.78 NFE2L2 (0.68) KEAP1NFE2L2MAPTTP53SPR

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-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-13 US disclosed
EP-1984355-A2 CYCLIC AMINE COMPOUND AND USE THEREOF FOR THE PROPHYLAXIS OR TREATMENT OF HYPERTENSION Takeda Pharmaceutical Company Limited (JP) 2008-10-29 EP disclosed
WO-2007094513-A2 CYCLIC AMINE COMPOUND AND USE THEREOF FOR THE PROPHYLAXIS OR TREATMENT OF HYPERTENSION TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-08-23 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-20100121048-A1 Cyclic Amine Compound and Use Thereof for the Prophylaxis or Treatment of Hypertension REN, AGTR1, AGTR2 KEAP1 488/4885NFE2L2 1103/4885MEN1 750/4885

“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.