SCHEMBL2299735

SCHEMBL2299735

COC(=O)[C@@H]1CCCN1C(=O)c1cc(-c2ccc(Nc3nc4ccc(F)cc4s3)cc2)no1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.42
CSGALNACT1 Q8TDX6 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
MAPT P10636 4/20 0.42
LMNA P02545 3/20 0.42
HPGD P15428 3/20 0.42
HTT P42858 2/20 0.42
GAA P10253 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
TNF P01375 1/20 0.42
NR2F2 P24468 1/20 0.42
KMT2A Q03164 1/20 0.42
MCL1 Q07820 1/20 0.42
KLF5 Q13887 1/20 0.42
NOD1 Q9Y239 1/20 0.42
LCK P06239 1/20 0.41
ITK Q08881 1/20 0.41
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 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
SCHEMBL2299738 1.00 DGAT1 (0.42) DGAT1CSGALNACT1SMN1; SMN2MAPTLMNA
SCHEMBL2296652 0.92 LMNA (0.42) SMN1; SMN2MAPTLMNAHPGDHTT
SCHEMBL2296648 0.92 LMNA (0.42) SMN1; SMN2MAPTLMNAHPGDHTT
SCHEMBL2294264 0.92 NPC1 (0.44) DGAT1CSGALNACT1SMN1; SMN2MAPTLMNA
SCHEMBL2294278 0.92 NPC1 (0.44) DGAT1CSGALNACT1SMN1; SMN2MAPTLMNA
SCHEMBL2294778 0.85 HCRTR1 (0.40) SMN1; SMN2MAPTLMNAHPGDHTT
SCHEMBL2294787 0.85 HCRTR1 (0.40) SMN1; SMN2MAPTLMNAHPGDHTT
SCHEMBL2296296 0.83 NPC1 (0.44) DGAT1SMN1; SMN2MAPTLMNAHPGD
SCHEMBL2296320 0.83 NPC1 (0.44) DGAT1SMN1; SMN2MAPTLMNAHPGD
SCHEMBL2294548 0.78 NPC1 (0.57) DGAT1CSGALNACT1SMN1; SMN2MAPTLMNA

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-8835428-B2 Diacylglycerol acyltransferase inhibitors Piramal Enterprises Limited (IN) 2014-09-16 US claimed
US-20110196002-A1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS PIRAMAL LIFE SCIENCES LIMITED. 2011-08-11 US claimed
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

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 DGAT1 1/4885CSGALNACT1 455/4885SMN1; SMN2 4532/4885

“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.