SCHEMBL2196984

SCHEMBL2196984

O=C(O)C1CCC(N2Cc3ccc(-c4ccc([N+](=O)[O-])cc4)cc3C2=O)CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
VCP P55072 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
NAMPT P43490 1/20 0.39
RHOA P61586 1/20 0.39
MAP3K5 Q99683 3/20 0.37
POLB P06746 2/20 0.36
TDP2 O95551 1/20 0.35
MAPK1 P28482 1/20 0.35
CRBN Q96SW2 1/20 0.35
MMP8 P22894 1/20 0.35

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
SCHEMBL2196992 1.00 MEN1 (0.43) MEN1KMT2AVCPTDP1NAMPT
SCHEMBL13718536 0.82 L3MBTL1 (0.38) KMT2APOLBTDP2MAPK1MMP8
SCHEMBL2198267 0.82 L3MBTL1 (0.38) KMT2APOLBTDP2MAPK1MMP8
SCHEMBL2197846 0.79 JAK2 (0.38) VCPMAP3K5MAPK1
SCHEMBL2195082 0.78 MAPT (0.43) MEN1KMT2APOLB
SCHEMBL13719196 0.76 KDM1A (0.45) POLBCRBN
SCHEMBL2196468 0.76 MCHR1 (0.39) TDP2
SCHEMBL2196467 0.76 MCHR1 (0.39) TDP2
SCHEMBL13719179 0.76 KDM1A (0.45) POLBCRBN
SCHEMBL31252799 0.75 SIRT2 (0.47) POLBTDP2CRBN

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8748426-B2 Inhibitors of diacylglycerol acyl transferase Piramal Enterprises Limited (IN) 2014-06-10 US disclosed
US-20120289505-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE Piramal Enterprises Limited (IN) 2012-11-15 US disclosed
EP-2519500-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE Piramal Healthcare Ltd. (IN) 2012-11-07 EP disclosed
WO-2011080718-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-07-07 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-20120289505-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE DGAT1, DGAT2, LCAT MEN1 3071/4885KMT2A 1705/4885VCP 1712/4885

“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.