SCHEMBL6015950

SCHEMBL6015950

O=C(O)Cn1c[c]c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
KDM4E B2RXH2 4/20 0.46
APEX1 P27695 1/20 0.46
STAT3 P40763 1/20 0.43
GLA P06280 1/20 0.42
ALDH1A1 P00352 4/20 0.41
MAPT P10636 3/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
ALOX12 P18054 1/20 0.40
RECQL P46063 1/20 0.40
GFER P55789 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL6015644 0.84 IDO1 (0.42) KMT2AKDM4EAPEX1ALDH1A1MEN1
SCHEMBL21052957 0.78 KDM4E (0.50) KMT2AKDM4EAPEX1STAT3GLA
SCHEMBL9581979 0.77
SCHEMBL3483121 0.76 KMT2A (0.56) KMT2AKDM4EAPEX1STAT3GLA
SCHEMBL6015734 0.75 KMT2A (0.50) KMT2AALDH1A1MAPTRECQLGAA
SCHEMBL6015632 0.75 SIGMAR1 (0.41) KMT2AALDH1A1MAPTLMNAGAA
SCHEMBL694560 0.74 TNF (0.44) KMT2AKDM4EALDH1A1MEN1LMNA
SCHEMBL6015666 0.73 PTGS2 (0.38) KMT2AKDM4EALDH1A1MAPTMEN1
SCHEMBL2544770 0.73 MEN1 (0.35) KMT2AKDM4EGLAALDH1A1MAPT
SCHEMBL6015880 0.73 POLB (0.51) KMT2AKDM4EGLAALDH1A1GAA

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-7049312-B1 Benzothiazinone and benzoxazinone compounds ABBOTT GMBH & CO. KG (DE) 2006-05-23 US claimed
CN-1636005-A Benzothiazinone and benzoxazinone compounds KNOLL AG (DE) 2005-07-06 CN claimed
EP-1181282-A2 BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2002-02-27 EP claimed
WO-2000075139-A2 BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2000-12-14 WO claimed
US-7049312-B1 Benzothiazinone and benzoxazinone compounds ABBOTT GMBH & CO. KG (DE) 2006-05-23 US disclosed
CN-1636005-A Benzothiazinone and benzoxazinone compounds KNOLL AG (DE) 2005-07-06 CN disclosed
EP-1181282-A2 BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2002-02-27 EP disclosed
WO-2000075139-A2 BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2000-12-14 WO disclosed
EP-0885186-A1 AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM Dr. Karl Thomae GmbH (DE) 1998-12-23 EP disclosed
US-5795887-A Method of inducing cholecystokinin agonist activity using 1,4- Benzodiazepine compounds GLAXO WELLCOME INC. (US) 1998-08-18 US disclosed
WO-1997019911-A1 AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM DR. KARL THOMAE GMBH (DE) 1997-06-05 WO disclosed
EP-0755394-A1 A METHOD OF INDUCING CHOLECYSTOKININ AGONIST ACTIVITY USING 1,4-BENZODIAZEPINE COMPOUNDS GLAXO WELLCOME INC. (US) 1997-01-29 EP disclosed
WO-1995028399-A1 A METHOD OF INDUCING CHOLECYSTOKININ AGONIST ACTIVITY USING 1,4-BENZODIAZEPINE COMPOUNDS GLAXO WELLCOME INC. (US) 1995-10-26 WO disclosed