SCHEMBL254705

SCHEMBL254705

COc1ccc(Cc2ccccc2O)cc1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.63
LTA4H P09960 1/20 0.60
HSPA5 P11021 1/20 0.54
ALOX5 P09917 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
CYP11B1 P15538 1/20 0.48
CYP11B2 P19099 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
MAOB P27338 1/20 0.47
SLC5A1 P13866 1/20 0.46
SLC5A2 P31639 1/20 0.46
CALM1 P0DP23 2/20 0.46
NPC1 O15118 1/20 0.46
PKM P14618 1/20 0.46
RAB9A P51151 1/20 0.46

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
Oxirane SCHEMBL27976841 0.92 KEAP1 (0.54) KEAP1LTA4HHSPA5ALOX5MEN1
SCHEMBL28251912 0.86 LTA4H (0.72) LTA4HMEN1KMT2ACYP11B1CYP11B2
SCHEMBL2027109 0.84 LTA4H (0.69) LTA4HMEN1KMT2ACYP11B1CYP11B2
SCHEMBL9776607 0.84 KEAP1 (0.86) KEAP1HSPA5ALOX5MEN1KMT2A
SCHEMBL30616875 0.84 KEAP1 (0.86) KEAP1HSPA5ALOX5MEN1KMT2A
SCHEMBL994168 0.84 ABCB1 (0.56) LTA4HSLC5A1SLC5A2CALM1NPC1
SCHEMBL2580611 0.82 KEAP1 (0.59) KEAP1LTA4HHSPA5MEN1KMT2A
SCHEMBL28849552 0.82 ALOX5 (0.48) KEAP1LTA4HALOX5MEN1KMT2A
SCHEMBL12869627 0.81 LTA4H (0.60) LTA4HMEN1KMT2ACYP11B1CYP11B2
SCHEMBL2580796 0.81 IGF1R (0.53) LTA4HMEN1KMT2ATDP1CALM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3315124-B1 BILAYER TABLET FORMULATIONS ASTRAZENECA AB (SE) 2021-01-06 EP disclosed
EP-2498759-B1 IMMEDIATE RELEASE TABLET FORMULATIONS ASTRAZENECA AB (SE) 2018-08-01 EP disclosed
EP-2714636-B9 FAMILY OF ARYL, HETEROARYL, O-ARYL AND O-HETEROARYL CARBASUGARS TFCHEM (FR) 2017-03-22 EP disclosed
US-9434670-B2 Family of aryl, heteroaryl, O-aryl and O-heteroaryl carbasugars TFCHEM (FR) 2016-09-06 US disclosed
US-9434670-B2 Family of aryl, heteroaryl, O-aryl and O-heteroaryl carbasugars TFCHEM (FR) 2016-09-06 US disclosed
EP-2714636-B1 FAMILY OF ARYL, HETEROARYL, O-ARYL AND O-HETEROARYL CARBASUGARS TFCHEM (FR) 2015-12-16 EP disclosed
WO-2015150299-A2 TREATMENT OF METABOLIC DISORDERS IN EQUINE ANIMALS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2015-10-08 WO disclosed
WO-2015110402-A1 TREATMENT OF METABOLIC DISORDERS IN CANINE ANIMALS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2015-07-30 WO disclosed
WO-2015091313-A1 TREATMENT OF METABOLIC DISORDERS IN FELINE ANIMALS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2015-06-25 WO disclosed
WO-2014161836-A1 TREATMENT OF METABOLIC DISORDERS IN EQUINE ANIMALS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2014-10-09 WO disclosed
US-20040018998-A1 Glucopyranosyloxybenzylbenzene derivatives and medicinal compositions containing the same KISSEI PHARMACEUTICAL CO., LTD. (JP) 2004-01-29 US disclosed
CN-1466590-A Glucopyranosyloxybenzylbenzene derivatives and medicinal compositions containing the same ����ҩƷ��ҵ��ʽ���� 2004-01-07 CN disclosed
EP-1329456-A1 GLUCOPYRANOSYLOXYBENZYLBENZENE DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Kissei Pharmaceutical Co., Ltd. (JP) 2003-07-23 EP disclosed
EP-1313560-A1 CATALYST FOR AROMATIC C-O, C-N, and C-C BOND FORMATION YALE UNIVERSITY (US) 2003-05-28 EP disclosed
CN-1418219-A Glucopyranosyloxy benzylbenzene derivatives, medicinal compositions containing the same and intermediates for the prepararation of the derivatives KISSEI PHARMACEUTICAL (JP) 2003-05-14 CN disclosed
US-6562989-B2 Bicyclopentyl iron ligand and transition metal catalyst YALE UNIVERSITY 2003-05-13 US disclosed
US-20030008768-A1 Catalyst for aromatic C-O, C-N, and C-C bond formation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-01-09 US disclosed
EP-1270584-A1 GLUCOPYRANOSYLOXY BENZYLBENZENE DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES FOR THE PREPARATION OF THE DERIVATIVES Kissei Pharmaceutical Co., Ltd. (JP) 2003-01-02 EP disclosed
WO-2002011883-A1 CATALYST FOR AROMATIC C-O, C-N, and C-C BOND FORMATION YALE UNIVERSITY (US) 2002-02-14 WO disclosed
US-4562211-A ANTIDEPRESSANTS MITSUBISHI CHEMICAL INDUSTRIES, LTD. (JP) 1985-12-31 US 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-20040018998-A1 Glucopyranosyloxybenzylbenzene derivatives and medicinal compositions containing the same SLC5A2, SLC5A1, SLC2A1 KEAP1 720/4885LTA4H 1822/4885HSPA5 1369/4885

“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.