SCHEMBL5599310

SCHEMBL5599310

O=[C]C(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.63
TDP1 Q9NUW8 1/20 0.63
LMNA P02545 5/20 0.55
CES2 O00748 2/20 0.55
CES1 P23141 2/20 0.55
ALDH1A1 P00352 4/20 0.46
CYP3A4 P08684 1/20 0.46
PTPN1 P18031 1/20 0.42
MDM2 Q00987 1/20 0.42
EPHX2 P34913 1/20 0.42
CYP2D6 P10635 1/20 0.41
SRC P12931 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
DAO P14920 1/20 0.41
TSHR P16473 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41

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
SCHEMBL9526813 1.00 L3MBTL1 (0.63) L3MBTL1TDP1LMNACES2CES1
SCHEMBL28126918 0.82 L3MBTL1 (0.61) L3MBTL1TDP1LMNACES2CES1
SCHEMBL5505530 0.82 L3MBTL1 (0.61) L3MBTL1TDP1LMNACES2CES1
SCHEMBL8111744 0.81 CES2 (0.50) L3MBTL1TDP1LMNACES2CES1
SCHEMBL28245619 0.80 SRC (0.52) L3MBTL1TDP1LMNACES2CES1
SCHEMBL7773819 0.80 SRC (0.52) L3MBTL1TDP1LMNACES2CES1
SCHEMBL2927912 0.78 L3MBTL1 (1.00) L3MBTL1TDP1LMNACES2CES1
SCHEMBL7202862 0.78 L3MBTL1 (0.55) L3MBTL1TDP1LMNACES2CES1
SCHEMBL5609578 0.77 EPHX1 (0.46) L3MBTL1TDP1LMNACES2CES1
SCHEMBL3237992 0.77 TDP1 (0.43) L3MBTL1TDP1LMNACES2CES1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005037797-A1 SUBSTITUTED PYRAZOLE UREA COMPOUNDS FOR THE TREATMENT OF INFLAMMATION PHARMACIA CORPORATION (US) 2005-04-28 WO claimed
EP-0099746-A1 C-23-modified derivatives of macrolide antibiotics ELI LILLY AND COMPANY (US) 1984-02-01 EP claimed
CN-112043724-A Application of arsenic-containing compound 常州高新技术产业开发区三维工业技术研究所有限公司 2020-12-08 CN disclosed
CN-111278840-A Pyrrolo [2, 3-B ] pyridine compounds and their use for treating cancer 癌症研究科技有限公司 2020-06-12 CN disclosed
CN-104105755-B PVC composition with high impact strength 巴斯夫欧洲公司 2017-01-18 CN disclosed
EP-1836248-A1 ANTISTATICALLY FINISHED POLYMER COMPOSITIONS THE PRODUCTION THEREOF AND THEIR USE Baerlocher GmbH (DE) 2007-09-26 EP disclosed
US-7199139-B2 Medicinal compositions containing diuretic and insulin resistance-improving agent SANKYO COMPANY, LIMITED (JP) 2007-04-03 US disclosed
EP-1354602-B1 MEDICINAL COMPOSITIONS CONTAINING DIURETIC AND INSULIN RESISTANCE-IMPROVING AGENT SANKYO CO (JP) 2006-10-04 EP disclosed
EP-1695716-A2 Medicinal compositions containing diuretics and insulin sensitizers Sankyo Company, Limited (JP) 2006-08-30 EP disclosed
WO-2006066834-A1 ANTISTATICALLY FINISHED POLYMER COMPOSITIONS THE PRODUCTION THEREOF AND THEIR USE BAERLOCHER GMBH (DE) 2006-06-29 WO disclosed
US-20050288339-A1 Medicinal compositions containing diuretic and insulin resistance-improving agent SANKYO COMPANY, LIMITED (JP) 2005-12-29 US disclosed
US-20040053974-A1 Medicinal compositions containing diuretic and insulin resistance-improving agent SANKYO COMPANY, LIMITED (JP) 2004-03-18 US disclosed
US-20040002512-A1 Alpha-substituted carboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2004-01-01 US disclosed
EP-1354602-A1 MEDICINAL COMPOSITIONS CONTAINING DIURETIC AND INSULIN RESISTANCE-IMPROVING AGENT Sankyo Company, Limited (JP) 2003-10-22 EP disclosed
US-6596751-B2 An insulin resistance improving agent, hypoglycemic agent, immunoregulatory agent, aldose reductase inhibitor, 5-lipoxygenase inhibitor, peroxidized lipid production suppressor, PPAR. activator, leukotriene antagonist, adipose SANKYO COMPANY LIMITED (JP) 2003-07-22 US disclosed
US-20030069294-A1 Alpha-substituted carboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-04-10 US disclosed
EP-1167357-A1 ALPHA-SUBSTITUTED CARBOXYLIC ACID DERIVATIVES Sankyo Company, Limited (JP) 2002-01-02 EP disclosed
EP-0988292-A2 PIPERAZINE DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 2000-03-29 EP disclosed
WO-1998056771-A2 PIPERAZINE DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 1998-12-17 WO disclosed
WO-1993005011-A1 NOVEL IMMUNOSUPPRESSANTS SANDOZ LTD. (CH) 1993-03-18 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 (4 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-20040002512-A1 Alpha-substituted carboxylic acid derivatives SLC5A1, SLC2A1, GPR119 L3MBTL1 1103/4885TDP1 4444/4885LMNA 3499/4885
US-20030069294-A1 Alpha-substituted carboxylic acid derivatives SLC5A1, SLC2A1, GPR119 L3MBTL1 1103/4885TDP1 4444/4885LMNA 3499/4885
US-20040053974-A1 Medicinal compositions containing diuretic and insulin resistance-improving agent GPR119, INSR, IRS1 L3MBTL1 4515/4885TDP1 4798/4885LMNA 1516/4885
US-20050288339-A1 Medicinal compositions containing diuretic and insulin resistance-improving agent GPR119, INSR, IRS1 L3MBTL1 4515/4885TDP1 4798/4885LMNA 1516/4885

“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.