SCHEMBL4319748

SCHEMBL4319748

CCOC(=O)CCC(=O)c1ccccc1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 9/20 0.57
WNT3A P56704 9/20 0.57
ABCB1 P08183 1/20 0.56
HDAC8 Q9BY41 1/20 0.54
HDAC1 Q13547 1/20 0.54
NPC1 O15118 1/20 0.53
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 2/20 0.51
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
IDO1 P14902 1/20 0.50
TDO2 P48775 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MEN1 O00255 1/20 0.49
PLIN1 O60240 1/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 1/20 0.49
PLIN5 Q00G26 1/20 0.49
ABHD5 Q8WTS1 1/20 0.49

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
SCHEMBL9348517 0.92 HDAC8 (0.59) CTNNB1WNT3AABCB1HDAC8HDAC1
SCHEMBL15979734 0.87 CTNNB1 (0.71) CTNNB1WNT3AHDAC8HDAC1NPC1
SCHEMBL954173 0.86 NPC1 (0.62) CTNNB1WNT3AABCB1HDAC8HDAC1
SCHEMBL30218361 0.86 NPC1 (0.62) CTNNB1WNT3AABCB1HDAC8HDAC1
SCHEMBL26644901 0.85 CTNNB1 (0.66) CTNNB1WNT3AHDAC8HDAC1NPC1
SCHEMBL31686110 0.85 CTNNB1 (0.66) CTNNB1WNT3AHDAC8HDAC1NPC1
SCHEMBL14925418 0.85 IDO1 (0.48) CTNNB1WNT3ANPC1KMT2AALDH1A1
SCHEMBL10834673 0.83 KDM4E (0.54) CTNNB1WNT3AKMT2AALDH1A1HTT
SCHEMBL3949459 0.82 CTNNB1 (0.54) CTNNB1WNT3AABCB1NPC1KMT2A
SCHEMBL5307918 0.82 CTNNB1 (0.61) CTNNB1WNT3AHDAC8HDAC1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9777015-B2 Useful thiophene derivatives in the treatment of diabetes METABRAIN RESEARCH (FR) 2017-10-03 US disclosed
US-20150197530-A1 USEFUL THIOPHENE DERIVATIVES IN THE TREATMENT OF DIABETES METABRAIN RESEARCH (FR) 2015-07-16 US disclosed
US-8865707-B2 Cholesteryl ester transfer protein inhibitors MERCK SHARP & DOHME CORP. (US) 2014-10-21 US disclosed
EP-1973546-B1 CHOLESTERYL ESTER TRANSFER PROTEIN INHIBITORS MERCK SHARP & DOHME (US) 2012-06-13 EP disclosed
US-20090018054-A1 Cholesteryl Ester Transfer Protein Inhibitors MERCK SHARP & DOHME LLC 2009-01-15 US disclosed
EP-1973546-A2 CHOLESTERYL ESTER TRANSFER PROTEIN INHIBITORS Merck & Co., Inc. (US) 2008-10-01 EP disclosed
WO-2007081570-A2 CHOLESTERYL ESTER TRANSFER PROTEIN INHIBITORS MERCK & CO., INC. (US) 2007-07-19 WO disclosed
US-5292768-A Compound effective as cerebral insufficiency improver SUNTORY LIMITED (JP) 1994-03-08 US disclosed
US-5288752-A Brain disorders SUNTORY LIMITED (JP) 1994-02-22 US disclosed
EP-0322248-B1 COMPOUNDS EFFECTIVE AGAINST CEREBRAL INSUFFICIENCY SUNTORY LIMITED (JP) 1993-08-04 EP disclosed
US-5179092-A Cognition activators SUNTORY LIMITED (JP) 1993-01-12 US disclosed
US-5057514-A Compounds effective as cerebral schemia treating agents SUNTORY LIMITED (JP) 1991-10-15 US disclosed
EP-0322248-A2 Compounds effective against cerebral insufficiency SUNTORY LIMITED (JP) 1989-06-28 EP 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 (2 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-20150197530-A1 USEFUL THIOPHENE DERIVATIVES IN THE TREATMENT OF DIABETES SLC5A2, SLC5A1, TPMT CTNNB1 1159/4885WNT3A 2277/4885ABCB1 366/4885
US-20090018054-A1 Cholesteryl Ester Transfer Protein Inhibitors CETP, APOB, MTTP CTNNB1 1467/4885WNT3A 1779/4885ABCB1 78/4885

“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.