SCHEMBL20549023

SCHEMBL20549023

CCCCCc1cccc2c1=NC(=O)N=2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 3/20 0.41
MCL1 Q07820 3/20 0.41
PPARA Q07869 3/20 0.41
BCL2L1 Q07817 2/20 0.41
BAK1 Q16611 2/20 0.41
KAT8 Q9H7Z6 2/20 0.41
PPARG P37231 2/20 0.41
SAE1 Q9UBE0 2/20 0.41
EP300 Q09472 1/20 0.41
KAT2A Q92830 1/20 0.41
KAT2B Q92831 1/20 0.41
KAT5 Q92993 1/20 0.41
LIPG Q9Y5X9 1/20 0.40
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
ALOX5 P09917 1/20 0.40
PTGS2 P35354 1/20 0.40
KCNH2 Q12809 1/20 0.40
GPR84 Q9NQS5 1/20 0.38
MMP2 P08253 2/20 0.36

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
SCHEMBL6208851 0.88 GABRA1 (0.36) ELANECTSG
SCHEMBL9164495 0.84
SCHEMBL3232243 0.83 GABRA1 (0.45) KCNH2ELANE
SCHEMBL7857695 0.83
SCHEMBL8932159 0.80 TDP1 (0.30)
SCHEMBL8301431 0.78
SCHEMBL7807775 0.78 HDAC3 (0.39) BIDMCL1PPARABCL2L1BAK1
SCHEMBL5602948 0.73 LIPG (0.42) BIDMCL1PPARABCL2L1BAK1
SCHEMBL5600911 0.72 LIPG (0.45) BIDMCL1PPARABCL2L1BAK1
SCHEMBL8203510 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106866569-A A kind of N arylation synthetic methods of benzoxazolone and benzimidazolone 常州大学 2017-06-20 CN claimed
CN-112789346-A Negative hydrogen ion donors as additives to reduce low speed pre-ignition events 雪佛龙奥伦耐有限责任公司 2021-05-11 CN disclosed
EP-3070092-B1 3-PHENYL-THIAZOLO[3,2-A]BENZIMIDAZOLE DERIVATIVES AS ALDEHYDE DEHYDROGENASE 1 (ALDH-1) MODULATORS FOR THE TREATMENT OF BREAST CANCER OR LEUKEMIA, AND FOR MANIPULATING CULTURED ALDH-1 POSITIVE BREAST CANCER OR LEUKEMIA CELLS UNIV KING SAUD (SA) 2018-11-07 EP disclosed
CN-106866569-A A kind of N arylation synthetic methods of benzoxazolone and benzimidazolone 常州大学 2017-06-20 CN disclosed
CN-106866569-A A kind of N arylation synthetic methods of benzoxazolone and benzimidazolone 常州大学 2017-06-20 CN disclosed
CN-1038586-C Pyrazine derivatives and process for preparing same OTSUKA PHARMA CO LTD (JP) 1998-06-03 CN disclosed
CN-1067053-A Pyrazines derivatives and preparation method thereof OTSUKA PHARMA CO LTD (JP) 1992-12-16 CN disclosed