SCHEMBL1428026

SCHEMBL1428026

CC(C)COc1ccc(NC(=O)NCCCl)cc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.54
MAPT P10636 5/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
KMT2A Q03164 2/20 0.48
NPC1 O15118 1/20 0.48
LMNA P02545 1/20 0.48
RAB9A P51151 1/20 0.48
POLB P06746 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CNR1 P21554 2/20 0.46
CASR P41180 1/20 0.46
FPR2 P25090 1/20 0.46
ADRB2 P07550 1/20 0.46
ADRB1 P08588 1/20 0.46
ADRB3 P13945 1/20 0.46
ACACB O00763 1/20 0.45
FAAH O00519 1/20 0.45
HRH3 Q9Y5N1 1/20 0.44

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
SCHEMBL6696313 0.84 MAPT (0.63) MAPTSMN1; SMN2KMT2ANPC1LMNA
SCHEMBL6692679 0.82 CA12 (0.58) EPHX2MAPTKMT2APOLBALDH1A1
SCHEMBL3146895 0.81 FPR2 (0.66) MAPTSMN1; SMN2KMT2ANPC1RAB9A
SCHEMBL6697390 0.80 CA12 (0.56) ALDH1A1FAAH
SCHEMBL6689381 0.78 FAAH (0.56) ALDH1A1FAAH
SCHEMBL6380819 0.78 EPHX1 (0.67) EPHX2SMN1; SMN2KMT2ANPC1RAB9A
SCHEMBL7308225 0.77 KMT2A (0.67) EPHX2MAPTSMN1; SMN2KMT2ANPC1
SCHEMBL6688599 0.77 NOX1 (0.61) SMN1; SMN2KMT2ANPC1RAB9AALDH1A1
SCHEMBL4950227 0.76 EPHX2 (0.48) EPHX2MAPTSMN1; SMN2KMT2ANPC1
SCHEMBL10802920 0.76 CNR1 (0.63) MAPTSMN1; SMN2KMT2ANPC1RAB9A

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-2300010-B1 PYRAZINE DERIVATIVES AS EPITHELIAL SODIUM CHANNEL BLOCKERS NOVARTIS AG (CH) 2015-03-04 EP disclosed
US-8236808-B2 Pyrazine derivatives as ENAC blockers NOVARTIS AG (CH) 2012-08-07 US disclosed
US-20110201625-A1 Organic Comopunds NOVARTIS AG (CH) 2011-08-18 US disclosed
CN-102112130-A Pyrazine derivatives as epithelial sodium channel blockers NOVARTIS AG 2011-06-29 CN disclosed
EP-2300010-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2011-03-30 EP disclosed
WO-2009150137-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-12-17 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-20110201625-A1 Organic Comopunds OR10J3, CFTR, CLIC1 EPHX2 1723/4885MAPT 1914/4885SMN1; SMN2 1984/4885

“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.