SCHEMBL6031069

SCHEMBL6031069

CCCCCCCCNC(=O)Nc1sc(C(=O)OC(CCCC)CCCC)c(C)c1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
TSHR P16473 2/20 0.40
EPHX1 P07099 11/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 3/20 0.39
POLB P06746 1/20 0.39
EPHX2 P34913 1/20 0.38
HPGD P15428 3/20 0.38
HSD17B10 Q99714 2/20 0.38
NPSR1 Q6W5P4 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL6029738 0.89 ALDH1A1 (0.42) ALDH1A1TSHREPHX1HTTMAPT
SCHEMBL6030207 0.88 ALDH1A1 (0.40) ALDH1A1TSHREPHX1HTTMAPT
SCHEMBL6030458 0.84 EPHX1 (0.48) ALDH1A1TSHREPHX1HTTMAPT
SCHEMBL6029736 0.84 ALDH1A1 (0.48) ALDH1A1TSHREPHX1HTTMAPT
SCHEMBL6030772 0.82 EPHX1 (0.46) ALDH1A1TSHREPHX1HTTMAPT
SCHEMBL6030269 0.82 EPHX1 (0.46) ALDH1A1TSHREPHX1HTTMAPT
SCHEMBL6030406 0.82 EPHX1 (0.46) ALDH1A1TSHREPHX1HTTMAPT
SCHEMBL6030371 0.82 EPHX1 (0.46) ALDH1A1TSHREPHX1HTTMAPT
SCHEMBL6031386 0.82 EPHX1 (0.40) ALDH1A1EPHX1HTTEPHX2
SCHEMBL6030484 0.80 MAPT (0.48) ALDH1A1TSHREPHX1HTTMAPT

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 5 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
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 ALDH1A1 1832/4885TSHR 212/4885EPHX1 938/4885

“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.