SCHEMBL2297789

SCHEMBL2297789

COC(=O)C(NC(=O)c1nc(-c2ccc(N)cc2)no1)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
GAA P10253 1/20 0.47
TAS1R3 Q7RTX0 1/20 0.44
TAS1R1 Q7RTX1 1/20 0.44
HDAC4 P56524 1/20 0.43
PPARD Q03181 3/20 0.42
PPARA Q07869 3/20 0.42
SCN10A Q9Y5Y9 1/20 0.42
TACR3 P29371 1/20 0.42
TP53 P04637 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ACACB O00763 5/20 0.40
SMPD1 P17405 1/20 0.40

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
SCHEMBL2300388 0.84 LMNA (0.45) KDM4EGAATAS1R3TAS1R1HDAC4
SCHEMBL2296821 0.82 CSGALNACT1 (0.53) TAS1R3TAS1R1SCN10ATP53SMN1; SMN2
SCHEMBL2296824 0.82 CSGALNACT1 (0.53) TAS1R3TAS1R1SCN10ATP53SMN1; SMN2
SCHEMBL2298788 0.82 CSGALNACT1 (0.54) GAASMN1; SMN2KMT2A
SCHEMBL2298791 0.82 CSGALNACT1 (0.54) GAASMN1; SMN2KMT2A
SCHEMBL2301331 0.81 SMN1; SMN2 (0.46) GAAHDAC4TACR3SMN1; SMN2KMT2A
SCHEMBL2301343 0.81 SMN1; SMN2 (0.46) GAAHDAC4TACR3SMN1; SMN2KMT2A
SCHEMBL3265091 0.81 KDM4E (0.47) KDM4EGAAHDAC4PPARDPPARA
SCHEMBL2297977 0.80 CSGALNACT1 (0.46) GAASCN10ASMN1; SMN2KMT2A
SCHEMBL2297973 0.80 CSGALNACT1 (0.46) GAASCN10ASMN1; SMN2KMT2A

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-8835428-B2 Diacylglycerol acyltransferase inhibitors Piramal Enterprises Limited (IN) 2014-09-16 US disclosed
US-20110196002-A1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS PIRAMAL LIFE SCIENCES LIMITED. 2011-08-11 US disclosed
WO-2010023609-A1 OXAZOLE, OXADIAZOLE AND THIAZOLE DERIVATIVES AS DIACYLGLYCEROL ACYLTRANFERASE INHIBITORS PIRAMAL LIFE SCIENCES LIMITED (IN) 2010-03-04 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-20110196002-A1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS DGAT1, DGAT2, DLAT KDM4E 4272/4885GAA 317/4885TAS1R3 3123/4885

“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.