SCHEMBL8901362

SCHEMBL8901362

Cc1cc(O)nc(CCl)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
KMT2A Q03164 2/20 0.33
MAPT P10636 1/20 0.32
GAA P10253 2/20 0.31
LMNA P02545 1/20 0.31
NPC1 O15118 3/20 0.31
RAB9A P51151 3/20 0.31
NOD1 Q9Y239 1/20 0.31
JAK2 O60674 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MAPK1 P28482 2/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.30
APOBEC3G Q9HC16 1/20 0.30
ALPL P05186 1/20 0.30
ALPG P10696 1/20 0.30
PLAA Q9Y263 1/20 0.30

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
SCHEMBL6631073 0.84 HTT (0.46) HTTSMN1; SMN2KMT2AMAPTGAA
SCHEMBL2117448 0.84
SCHEMBL4288745 0.80 HTT (0.41) HTTKDM4EALDH1A1KMT2AMAPT
SCHEMBL3861126 0.78 MAPT (0.41) HTTKDM4EALDH1A1KMT2AMAPT
SCHEMBL9252957 0.78 HTT (0.44) HTTKDM4EALDH1A1KMT2AGAA
SCHEMBL11077413 0.77 HTT (0.50) HTTSMN1; SMN2KDM4EALDH1A1KMT2A
SCHEMBL9843905 0.77 HTT (0.38) HTTALDH1A1NPC1RAB9AMAPK1
SCHEMBL11362095 0.76 SMN1; SMN2 (0.34) SMN1; SMN2KMT2A
SCHEMBL11346997 0.75 HTT (0.37) HTTKDM4EALDH1A1KMT2AMAPT
SCHEMBL11334859 0.75 HTT (0.37) HTTKDM4EALDH1A1KMT2ALMNA

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
CN-116354936-A Novel heterocyclic compounds useful as selective AURORA a inhibitors 北京加科思新药研发有限公司 2023-06-30 CN disclosed
CN-114423751-B Novel heterocyclic compounds useful as selective AURORA a inhibitors 北京加科思新药研发有限公司 2023-04-21 CN disclosed
EP-4093736-A1 NOVEL HETEROCYCLIC COMPOUNDS USEFUL AS AURORA A SELECTIVE INHIBITORS Jacobio Pharmaceuticals Co., Ltd. (CN) 2022-11-30 EP disclosed
CN-114423751-A Novel heterocyclic compounds useful as selective AURORA a inhibitors 北京加科思新药研发有限公司 2022-04-29 CN disclosed
WO-2021147974-A1 NOVEL HETEROCYCLIC COMPOUNDS USEFUL AS AURORA A SELECTIVE INHIBITORS JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2021-07-29 WO disclosed
WO-1997038995-A1 FUNGICIDAL OXAZOLIDINEDIONE DERIVATIVES ZENECA LIMITED (GB) 1997-10-23 WO disclosed
EP-0015078-B1 ORGANO-PHOSPHORIC ESTERS, THEIR PRODUCTION AND USE AS PESTICIDES, AS WELL AS THE INTERMEDIATES THEREOF AND THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-07-04 EP disclosed
US-4326058-A INSECTICIDE, ACARICIDE, AND NEMATOCIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-04-20 US disclosed
EP-0002200-B1 N,N-DIALKYL-O-PYRIMIDINYL-CARBAMIC ACID ESTERS, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS INSECTICIDES BAYER AG (DE) 1981-09-02 EP disclosed
EP-0015078-A2 Organo-phosphoric esters, their production and use as pesticides, as well as the intermediates thereof and their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-09-03 EP disclosed
US-4200637-A Combating arthropods with N,N-dialkyl-O-(2-substituted-methyl-pyrimidin-4-yl)-carbamic acid esters BAYER AKTIENGESELLSCHAFT (DE) 1980-04-29 US disclosed
EP-0002200-A1 N,N-dialkyl-O-pyrimidinyl-carbamic acid esters, process for their preparation, and their use as insecticides BAYER AG (DE) 1979-06-13 EP disclosed
EP-0001602-A1 Substituted pyrimidinyl(thiono)(thiol)phosphoric(phosphonic) acid esters and ester amides, process for their preparation and their use as insecticides and acaricides BAYER AG (DE) 1979-05-02 EP disclosed