SCHEMBL788918

SCHEMBL788918

CCOC(=O)c1oc2ccc(Br)cc2c1C

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.67
HIF1A Q16665 5/20 0.66
LMNA P02545 2/20 0.61
TSHR P16473 2/20 0.61
ALDH1A1 P00352 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
HPGD P15428 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
CASP6 P55212 1/20 0.56
KMT2A Q03164 2/20 0.56
PARG Q86W56 2/20 0.56
POLB P06746 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
MEN1 O00255 1/20 0.55
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
MAPT P10636 1/20 0.55
USP2 O75604 1/20 0.55
KDM4E B2RXH2 1/20 0.55
AHR P35869 1/20 0.55

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
SCHEMBL17205250 0.91 HIF1A (0.56) KCNH2HIF1ALMNATSHRALDH1A1
SCHEMBL13102768 0.89 KDM4E (0.67) KCNH2HIF1ALMNATSHRALDH1A1
SCHEMBL3500416 0.89 HIF1A (0.57) KCNH2HIF1ALMNATSHRALDH1A1
SCHEMBL6839579 0.87 ALOX5 (0.58) KCNH2HIF1ALMNATSHRALDH1A1
SCHEMBL28426041 0.86 HIF1A (0.73) HIF1A
SCHEMBL717905 0.85 KCNH2 (0.67) KCNH2HIF1ALMNATSHRALDH1A1
SCHEMBL19661983 0.85 KCNH2 (0.66) KCNH2HIF1ATSHRALDH1A1NPSR1
SCHEMBL23218446 0.85 PLK1 (0.70) KCNH2HIF1ALMNATSHRALDH1A1
SCHEMBL1474090 0.84 MEN1 (0.60) HIF1ATSHRALDH1A1SMN1; SMN2HPGD
SCHEMBL16732898 0.83 KDM4E (0.62) HIF1ALMNATSHRALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3621956-A2 A METHOD FOR PRODUCING POTASSIUM 1,1 -DINITRAMINO-5,5-BISTETRAZOLATE AND EXPLOSIVE COMPOSITIONS COMPRISING SAID SALT Detnet South Africa (Pty) Ltd (ZA) 2020-03-18 EP claimed
WO-2018209366-A2 EXPLOSIVE COMPOUND AND METHOD OF MANUFACTURING SAME DETNET SOUTH AFRICA (PTY) LTD (ZA) 2018-11-15 WO claimed
EP-4267555-A1 OCTAHYDROISOQUINOLINYL DERIVATIVES UCB Biopharma SRL (BE) 2023-11-01 EP disclosed
EP-4263517-A1 A SUBSTITUTED TETRAHYDROISOQUINOLINE DERIVATIVE AS A D1 POSITIVE ALLOSTERIC MODULATOR UCB Biopharma SRL (BE) 2023-10-25 EP disclosed
EP-4262756-A1 AMORPHOUS SOLID DISPERSIONS UCB Biopharma SRL (BE) 2023-10-25 EP disclosed
WO-2023180964-A1 PYRAZINE AMIDE DERIVATIVES NOVARTIS AG (CH) 2023-09-28 WO disclosed
EP-4228650-A1 INHALED FORMULATIONS OF PGDH INHIBITORS AND METHODS OF USE THEREOF Epirium Bio Inc. (US) 2023-08-23 EP disclosed
WO-2022129268-A1 A SUBSTITUTED TETRAHYDROISOQUINOLINE DERIVATIVE AS A D1 POSITIVE ALLOSTERIC MODULATOR UCB Biopharma SRL (BE) 2022-06-23 WO disclosed
WO-2022129267-A1 AMORPHOUS SOLID DISPERSIONS UCB Biopharma SRL (BE) 2022-06-23 WO disclosed
WO-2022117678-A1 OCTAHYDROISOQUINOLINYL DERIVATIVES UCB Biopharma SRL (BE) 2022-06-09 WO disclosed
EP-4003516-A1 PYRIDINE DERIVATIVES AS TMEM16A MODULATORS FOR USE IN THE TREATMENT OF RESPIRATORY CONDITIONS TMEM16A LIMITED (GB) 2022-06-01 EP disclosed
US-5962695-A ANTICOAGULANT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-10-05 US disclosed
US-5866577-A AN ANTICOAGULANT AGENT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-02-02 US disclosed
CN-1168886-A Process for production of amidinobenzofuran and amidionbenzothiophen derivatives and salt thereof DAIICHI SEIYAKU CO (JP) 1997-12-31 CN disclosed
CN-1168885-A Process for prodn. of amidinoindole derivatives and salts thereof DAIICHI SEIYAKU CO (JP) 1997-12-31 CN disclosed
US-5620991-A ANTICOAGULANTS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-04-15 US disclosed
US-5576343-A ANTICOAGULANTS; BLOOD-COAGULATION FACTOR X INHIBITORS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1996-11-19 US disclosed
EP-0540051-B1 Aromatic amidine derivatives and salts thereof DAIICHI SEIYAKU CO (JP) 1996-04-03 EP disclosed
CN-1072677-A Aromatic amidine derivative and salt thereof DAIICHI SEIYAKU CO (JP) 1993-06-02 CN disclosed
EP-0540051-A1 Aromatic amidine derivatives and salts thereof DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1993-05-05 EP disclosed