SCHEMBL6271004

SCHEMBL6271004

COC(=O)C1CC(=O)N(c2ccc(OC)cc2)C1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.76
GAA P10253 1/20 0.76
CA12 O43570 1/20 0.68
CA1 P00915 1/20 0.68
CA2 P00918 1/20 0.68
CA4 P22748 1/20 0.68
CA6 P23280 1/20 0.68
CA7 P43166 1/20 0.68
CA9 Q16790 1/20 0.68
CA13 Q8N1Q1 1/20 0.68
CA14 Q9ULX7 1/20 0.68
CA5B Q9Y2D0 1/20 0.68
HTT P42858 1/20 0.65
LMNA P02545 3/20 0.64
MAPT P10636 2/20 0.64
CYP2C9 P11712 2/20 0.63
CYP1A2 P05177 1/20 0.63
CYP3A4 P08684 1/20 0.63
CYP2C19 P33261 1/20 0.63
KMT2A Q03164 1/20 0.61

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
SCHEMBL3365230 0.92 ALDH1A1 (0.67) ALDH1A1GAACA12CA1CA2
SCHEMBL3365239 0.92 ALDH1A1 (0.67) ALDH1A1GAACA12CA1CA2
SCHEMBL3365236 0.92 ALDH1A1 (0.67) ALDH1A1GAACA12CA1CA2
SCHEMBL3365948 0.90 ALDH1A1 (0.74) ALDH1A1GAACA12CA1CA2
SCHEMBL3365950 0.90 ALDH1A1 (0.74) ALDH1A1GAACA12CA1CA2
SCHEMBL19793283 0.87 MAPK1 (0.70) ALDH1A1GAACA12CA1CA2
SCHEMBL1777398 0.87 ALDH1A1 (0.70) ALDH1A1GAACA12CA1CA2
SCHEMBL3365627 0.87 ALDH1A1 (0.70) ALDH1A1GAACA12CA1CA2
SCHEMBL9031939 0.87 MAPK1 (0.70) ALDH1A1GAACA12CA1CA2
SCHEMBL6270203 0.87 HTT (0.63) ALDH1A1GAACA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1000620-B1 Lp(a)-LOWERING AGENTS AND APOPROTEIN (a) PRODUCTION INHIBITORS TAIHO PHARMACEUTICAL CO LTD (JP) 2005-12-07 EP disclosed
US-6166036-A Lp(a)-lowering agent and apolipoprotein (a) formation suppressing agent TAIHO PHARMACEUTICAL CO., LTD. (JP) 2000-12-26 US disclosed
EP-1000620-A1 Lp(a)-LOWERING AGENTS AND APOPROTEIN (a) PRODUCTION INHIBTORS TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 2000-05-17 EP disclosed
US-5990139-A 2,5-DIOXO-4-(PYRIDYL OR PHENYL-(N-HETEROCYCLE(C4N,C3N2))-ALKYLENOXY-(1,4-PHENYLENE) -)THIADIAZOLIDINES; ANTIDIABETIC AND -LIPEMIC AGENTS; SIDE EFFECT REDUCTION TAIHO PHARMACEUTICAL CO., LTD. (JP) 1999-11-23 US disclosed
EP-0393607-B1 Phenylcarboxylic acid derivatives having a hetero ring OTSUKA PHARMA CO LTD (JP) 1996-02-21 EP disclosed
US-5145865-A Fatty acid, cholesterol synthesis inhibitors; enzyme inhibitors; antilipemic agents OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1992-09-08 US disclosed
EP-0393607-A2 Phenylcarboxylic acid derivatives having a hetero ring OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-10-24 EP disclosed