SCHEMBL1769732

SCHEMBL1769732

O=c1ccc(-c2cccc(C(F)(F)F)c2)n[nH]1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.62
NTRK1 P04629 1/20 0.62
RET P07949 1/20 0.62
PDGFRB P09619 1/20 0.62
CDK8 P49336 1/20 0.62
NTRK3 Q16288 1/20 0.62
NTRK2 Q16620 1/20 0.62
AURKB Q96GD4 1/20 0.62
CYP1A2 P05177 1/20 0.57
XDH P47989 1/20 0.56
IDO1 P14902 1/20 0.55
NOTUM Q6P988 1/20 0.55
AKR1B1 P15121 2/20 0.55
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
POLB P06746 1/20 0.51
PIM1 P11309 2/20 0.50
MAP4K4 O95819 1/20 0.50
GPX4 P36969 1/20 0.50
GSK3B P49841 1/20 0.50

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
SCHEMBL1769639 0.89 JAK2 (0.53) JAK2NTRK1RETPDGFRBCDK8
SCHEMBL10353459 0.83 CYP1A2 (0.74) JAK2NTRK1RETPDGFRBCDK8
SCHEMBL10966762 0.80 LMNA (0.61) JAK2NTRK1RETPDGFRBCDK8
SCHEMBL8897726 0.79 JAK2 (0.46) JAK2NTRK1RETPDGFRBCDK8
SCHEMBL11622724 0.79 NOTUM (0.55) JAK2NTRK1RETPDGFRBCDK8
SCHEMBL11515630 0.79 IDO1 (0.60) XDHIDO1NOTUMMEN1KMT2A
SCHEMBL1301730 0.79 CYP1A2 (0.62) CYP1A2IDO1NOTUMMEN1KMT2A
Hydrochloric Acid SCHEMBL30367906 0.79 LMNA (0.59) JAK2NTRK1RETPDGFRBCDK8
SCHEMBL24155844 0.78 JAK2 (0.50) JAK2NTRK1RETPDGFRBCDK8
SCHEMBL23013618 0.78 IDO1 (0.55) JAK2NTRK1RETPDGFRBCDK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0141847-A1 PYRIDAZINONE, PREPARATION PROCESS THEREOF AND UTILISATION THEREOF, DRUGS CONTAINING PYRIDAZINONE Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1985-05-22 EP claimed
WO-1984004522-A1 PYRIDAZINONE, PREPARATION PROCESS THEREOF AND UTILISATION THEREOF, DRUGS CONTAINING PYRIDAZINONE BYK GULDEN LOMBERG CHEM FAB (DE) 1984-11-22 WO claimed
CN-117510470-A Pyridazinone compounds and application thereof 暨南大学 2024-02-06 CN disclosed
WO-2021033141-A1 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS PEST CONTROL AGENTS PI INDUSTRIES LTD. (IN) 2021-02-25 WO disclosed
EP-2604597-B1 HETEROCYCLIC COMPOUND AND USE THEREOF INHIBITOR OF PHOSPHODIESTERASE 10A TAKEDA PHARMACEUTICALS CO (JP) 2017-01-04 EP disclosed
CN-103804312-B Aza cyclic cpds and its production and use BAILI PHARMACEUTICAL CO., LTD., SICHUAN PROV. (CN) 2016-04-20 CN disclosed
US-9212146-B2 Substituted pyridazinones for the treatment of tumors SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2015-12-15 US disclosed
US-9212146-B2 Substituted pyridazinones for the treatment of tumors SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2015-12-15 US disclosed
CN-105061326-A Pyridazinone derivatives as well as preparation method and application thereof SICHUAN BAILI PHARMACEUTICAL CO LTD 2015-11-18 CN disclosed
US-9150588-B2 Substituted pyridazin-4(1H)-ones as phosphodiesterase 10A inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-10-06 US disclosed
CN-103804312-A Nitrogen heterocyclic compounds as well as preparation method and application thereof SICHUAN BAILI PHARMACEUTICAL CO LTD 2014-05-21 CN disclosed
WO-2009114994-A1 THE USE OF THE PYRIDAZINONE DERIVATIVES FOR THE MANUFACTURE OF MEDICAMENT FOR ANTI-TUMOUR 中国科学院上海药物研究所 (CN) 2009-09-24 WO disclosed
WO-2009114993-A1 PYRIDAZINONES, THE PREPARATION AND THE USE THEREOF 中国科学院上海药物研究所 (CN) 2009-09-24 WO disclosed
US-5462914-A Reacting a hydroxypyridazine salt with a cyanogen halide SANDOZ LTD. (CH) 1995-10-31 US disclosed
EP-0556647-A1 N-cyanopyridazinones as herbicides SANDOZ LTD. (CH) 1993-08-25 EP disclosed
EP-0141847-A1 PYRIDAZINONE, PREPARATION PROCESS THEREOF AND UTILISATION THEREOF, DRUGS CONTAINING PYRIDAZINONE Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1985-05-22 EP disclosed
WO-1984004522-A1 PYRIDAZINONE, PREPARATION PROCESS THEREOF AND UTILISATION THEREOF, DRUGS CONTAINING PYRIDAZINONE BYK GULDEN LOMBERG CHEM FAB (DE) 1984-11-22 WO disclosed
US-4117130-A 6-PHENYL-1,2,4-TRIAZOLO(4,3-B)PYRIDAZINES AMERICAN CYANAMID COMPANY (US) 1978-09-26 US disclosed
US-4112095-A 6-Phenyl-1,2,4-triazolo[4,3-b]pyridazine hypotensive agents AMERICAN CYANAMID COMPANY (US) 1978-09-05 US disclosed
US-4092311-A Hypotensive alkyl-3-[6-(aryl)-3-pyridazinyl]-carbazates AMERICAN CYANAMID COMPANY (US) 1978-05-30 US disclosed