SCHEMBL2179865

SCHEMBL2179865

CCCCCc1ccc(C(=O)Nc2ccc(-c3ccc4c(c3)C(=O)N(C(C)(C)C(=O)OC)C4)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
NPC1 O15118 1/20 0.43
GALR3 O60755 1/20 0.43
RAB9A P51151 1/20 0.43
TRPV1 Q8NER1 9/20 0.43
PLK1 P53350 2/20 0.41
GAA P10253 1/20 0.41
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NR1H4 Q96RI1 1/20 0.40
MCHR1 Q99705 1/20 0.39
PLK3 Q9H4B4 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
RARB P10826 1/20 0.39

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
SCHEMBL2178865 0.91 TRPV1 (0.47) KDM4ENPC1GALR3RAB9ATRPV1
SCHEMBL2177022 0.85 TRPV1 (0.47) NPC1RAB9ATRPV1TP53MAPT
SCHEMBL13718608 0.85 PTPN1 (0.47) KDM4ETRPV1GAAMAPTSMN1; SMN2
SCHEMBL2178147 0.85 NPC1 (0.46) NPC1RAB9ASMN1; SMN2MCHR1
SCHEMBL2180341 0.83 TRPV1 (0.53) NPC1RAB9ATRPV1MAPT
SCHEMBL2179294 0.82 KDM4E (0.41) KDM4ENPC1GALR3RAB9ATRPV1
SCHEMBL2180852 0.80 KDM4E (0.41) KDM4ETRPV1PLK1GAATP53
SCHEMBL2178572 0.80 KDM4E (0.41) KDM4ETRPV1PLK1GAATP53
SCHEMBL2177806 0.80 TRPV1 (0.44) KDM4ETRPV1PLK1GAATP53
SCHEMBL2177810 0.79 KDM4E (0.41) KDM4ENPC1GALR3RAB9ATRPV1

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 8 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 claimed
US-20120289505-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE Piramal Enterprises Limited (IN) 2012-11-15 US claimed
EP-2519500-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE Piramal Healthcare Ltd. (IN) 2012-11-07 EP claimed
WO-2011080718-A1 INHIBITORS OF DIACYLGLYCEROL ACYL TRANSFERASE PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-07-07 WO claimed
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 KDM4E 3647/4885NPC1 158/4885GALR3 2598/4885

“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.