SCHEMBL6031270

SCHEMBL6031270

CCCCCCCCCCc1cc(C(=O)O)c(NC(=O)OCc2ccccc2)s1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 3/20 0.46
NPSR1 Q6W5P4 2/20 0.45
MAPT P10636 1/20 0.45
PLK1 P53350 4/20 0.45
PLK3 Q9H4B4 3/20 0.45
GLS O94925 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CCNE1 P24864 1/20 0.43
CDK2 P24941 1/20 0.43
CDK5 Q00535 1/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
CYP3A4 P08684 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL28751502 0.97 HSD17B10 (0.47) HSD17B10SMN1; SMN2ALDH1A1NPSR1MAPT
SCHEMBL6030068 0.92 HSD17B10 (0.48) HSD17B10PLK1PLK3PPARGPPARA
SCHEMBL6029893 0.92 HSD17B10 (0.46) HSD17B10SMN1; SMN2ALDH1A1NPSR1MAPT
SCHEMBL6030216 0.90 GAA (0.48) HSD17B10SMN1; SMN2ALDH1A1NPSR1MAPT
SCHEMBL6030384 0.90 GAA (0.45) HSD17B10SMN1; SMN2ALDH1A1NPSR1MAPT
SCHEMBL6030363 0.89 NPC1 (0.51) HSD17B10SMN1; SMN2ALDH1A1PLK1PLK3
SCHEMBL6031150 0.89 GAA (0.50) HSD17B10SMN1; SMN2PLK1PLK3GLS
SCHEMBL6030057 0.89 GAA (0.50) HSD17B10SMN1; SMN2PLK1PLK3GLS
SCHEMBL6029701 0.89 GAA (0.50) HSD17B10SMN1; SMN2PLK1PLK3GLS
SCHEMBL6031643 0.88 HSD17B10 (0.49) HSD17B10SMN1; SMN2ALDH1A1NPSR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7064122-B2 Pancreatic lipase inhibitor compounds, their synthesis and use OSI PHARMACEUTICALS, INC. (US) 2006-06-20 US disclosed
EP-1467978-A4 PANCREATIC LIPASE INHIBITOR COMPOUNDS, THEIR SYNTHESIS AND USE OSI PHARM INC (US) 2005-11-02 EP disclosed
CN-1620439-A Pancreatic lipase inhibitor compound, and synthesis method and application thereof OSI PHARM INC (US) 2005-05-25 CN disclosed
EP-1467978-A1 PANCREATIC LIPASE INHIBITOR COMPOUNDS, THEIR SYNTHESIS AND USE OSI Pharmaceuticals, Inc. (US) 2004-10-20 EP disclosed
US-20030195199-A1 Pancreatic lipase inhibitor compounds, their synthesis and use OSI PHARMACEUTICALS, INC. 2003-10-16 US disclosed
WO-2003053944-A1 PANCREATIC LIPASE INHIBITOR COMPOUNDS, THEIR SYNTHESIS AND USE OSI PHARMACEUTICALS, INC. (US) 2003-07-03 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-20030195199-A1 Pancreatic lipase inhibitor compounds, their synthesis and use PNLIP, LIPC, CEL HSD17B10 126/4885SMN1; SMN2 1723/4885ALDH1A1 1832/4885

“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.