SCHEMBL1250424

SCHEMBL1250424

CNC(=O)COc1cc(C)c(-c2nc3ccc(C(=O)Nc4ccc5sc(C)nc5c4)cc3[nH]2)c(C)c1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 7/20 0.65
MAPT P10636 6/20 0.47
HTT P42858 1/20 0.47
TRPV1 Q8NER1 1/20 0.47
HDAC3 O15379 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
LMNA P02545 2/20 0.45
RAB9A P51151 4/20 0.44
NPC1 O15118 3/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
CYP3A4 P08684 1/20 0.42

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
SCHEMBL1251610 0.92 DGAT1 (0.77) DGAT1MAPTHTTTRPV1HDAC3
SCHEMBL1251408 0.91 DGAT1 (0.66) DGAT1MAPTHTTTRPV1HDAC3
SCHEMBL1250680 0.90 DGAT1 (0.64) DGAT1MAPTHTTTRPV1HDAC3
SCHEMBL1250286 0.90 DGAT1 (0.64) DGAT1MAPTHTTTRPV1HDAC3
SCHEMBL15252817 0.88 DGAT1 (0.49) DGAT1MAPTHTTLMNARAB9A
SCHEMBL1250186 0.88 DGAT1 (0.83) DGAT1MAPTHDAC3HDAC7HDAC6
SCHEMBL1250693 0.87 DGAT1 (0.60) DGAT1MAPTHTTTRPV1HDAC3
SCHEMBL1248433 0.85 DGAT1 (0.60) DGAT1MAPTHTTTRPV1HDAC3
SCHEMBL1251630 0.82 DGAT1 (0.58) DGAT1MAPTHTTTRPV1HDAC3
SCHEMBL3171341 0.82 DGAT1 (0.62) DGAT1HDAC3HDAC7HDAC6HDAC9

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-8222248-B2 Organic compounds NOVARTIS AG (CH) 2012-07-17 US disclosed
US-20110046133-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-02-24 US disclosed
US-20110046133-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-02-24 US 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-20110046133-A1 ORGANIC COMPOUNDS DGAT1, DGAT2, SOAT1 DGAT1 1/4885MAPT 1210/4885HTT 845/4885

“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.