SCHEMBL6958276

SCHEMBL6958276

COC(=O)CCC(Cl)C(=O)Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 4/20 0.50
▸ SLC1A1 P43005 1/20 0.42
▸ KMT2A Q03164 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ LMNA P02545 3/20 0.38
▸ CA12 O43570 2/20 0.38
▸ CA14 Q9ULX7 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ HSD17B10 Q99714 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ MGAM O43451 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ SI P14410 1/20 0.36
▸ MGAM2 Q2M2H8 1/20 0.36
▸ CA7 P43166 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ RECQL P46063 1/20 0.33

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
SCHEMBL10683179 1.00 TSHR (0.50) TSHRSLC1A1KMT2AMEN1LMNA
SCHEMBL10676771 0.83 TSHR (0.50) TSHRSLC1A1KMT2AMEN1LMNA
SCHEMBL8092036 0.83 TSHR (0.50) TSHRSLC1A1KMT2AMEN1LMNA
SCHEMBL10676780 0.83 TSHR (0.50) TSHRSLC1A1KMT2AMEN1LMNA
SCHEMBL10682900 0.83 TSHR (0.50) TSHRSLC1A1KMT2AMEN1LMNA
SCHEMBL11004183 0.79 TSHR (0.57) TSHRSLC1A1KMT2AMEN1LMNA
SCHEMBL28793446 0.79 — —
SCHEMBL9387597 0.79 TSHR (0.46) TSHRSLC1A1KMT2AMEN1LMNA
SCHEMBL13862603 0.78 TSHR (0.50) TSHRSLC1A1KMT2AMEN1LMNA
SCHEMBL7315349 0.78 TSHR (0.50) TSHRSLC1A1KMT2AMEN1LMNA

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
EP-0567026-B1 4,1-Benzoxazepin derivatives as squalene synthase inhibitors and their use in the treatment of hypercholesteremia and as fungicides TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-03-26 — — EP disclosed
CN-1044237-C 4,1-benzoxazep in derivatives and their use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1999-07-21 — — CN disclosed
US-5885979-A SQUALENE SYNTHETASE INHIBITOR TREATING OR PREVENTING HYPERLIPIDEMIA TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-03-23 — — US disclosed
US-5726306-A INHIBITORS OF SQUALENE SYNTHETASE AND FUNGAL GROWTH; USEFUL IN TREATING AND PREVENTING HYPERLIPIDEMIA TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-10 — — US disclosed
CN-1083481-A 4,1-Benzoxazepine derivatives and its purposes TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1994-03-09 — — CN disclosed
EP-0567026-A1 4,1-Benzoxazepin derivatives as squalene synthase inhibitors and their use in the treatment of hypercholesteremia and as fungicides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-10-27 — — EP disclosed
US-4789675-A HYPOTENSIVE, ANTIISCHEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-12-06 — — US disclosed
CN-87100658-A 1,4-benzoxazine derivatives, their preparation and application — 1987-09-09 — — CN disclosed
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