SCHEMBL27751908

SCHEMBL27751908

COC(=O)C1=CC=CNC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.44
LMNA P02545 2/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
THRB P10828 1/20 0.36
CHRM1 P11229 1/20 0.36
BLM P54132 1/20 0.35
MCOLN3 Q8TDD5 1/20 0.35
KDM4E B2RXH2 3/20 0.33
MAPK1 P28482 3/20 0.33
PTPN1 P18031 1/20 0.33
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 1/20 0.32
CA12 O43570 3/20 0.31
CA1 P00915 3/20 0.31
CA2 P00918 3/20 0.31

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
SCHEMBL29600745 0.80 TP53 (0.31) CA12CA1CA2CA9CA14
SCHEMBL9045453 0.80 KDM4E (0.40) LMNAKDM4EHPGDTSHRCA12
SCHEMBL5660573 0.77 HDAC2 (0.31)
SCHEMBL2301074 0.75
Hydrochloric Acid SCHEMBL10438113 0.74 BLM (0.41) LMNATHRBBLMMAPK1TSHR
Hydrochloric Acid SCHEMBL17597680 0.74 BLM (0.41) LMNATHRBBLMMAPK1TSHR
SCHEMBL1017726 0.74
SCHEMBL13018296 0.73 MMP1 (0.34) KDM4EMAPK1GAA
SCHEMBL22411680 0.72
Hydrochloric Acid SCHEMBL30468940 0.72 THRB (0.36) THRBBLMMAPK1TSHRTDP1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023169336-A1 PYRIDAZINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF 成都科岭源医药技术有限公司 2023-09-14 WO disclosed
CN-110041316-A TAM family kinase/and CSF1R kinase inhibitor and application thereof 南京药捷安康生物科技有限公司 2019-07-23 CN disclosed
CN-105541833-B Derivative of the dihydropyridine of pyridiniujm/1,4 and preparation method thereof 华东理工大学 2018-02-16 CN disclosed
CN-106478496-A Dihydropyridine sulfonamide and dihydropyridine sulphamide as mek inhibitor 阿迪生物科学公司 2017-03-08 CN disclosed
CN-105683191-A Protein kinase inhibitor containing pyrrolopyridazine derivative CJ医药健康株式会社 2016-06-15 CN disclosed
CN-101511789-B 5, 6-bisaryl-2-pyridine-carboxamide derivatives, their preparation and their use in therapy as urotensin II receptor antagonists SANOFI AVENTIS 2012-05-23 CN disclosed
CN-102105462-A Amidophenoxyindazoles useful as inhibitors of C-MET LILLY CO ELI 2011-06-22 CN disclosed
CN-101896227-A Combination comprising an MEK inhibitor and an aurora kinase inhibitor ASTRAZENECA AB 2010-11-24 CN disclosed
CN-101511789-A 5, 6-bisaryl-2-pyridine-carboxamide derivatives, their preparation and their use in therapy as urotensin II receptor antagonists SANOFI AVENTIS (FR) 2009-08-19 CN disclosed