SCHEMBL418096

SCHEMBL418096

CC(C)(C)N(N)C(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.53
ALDH1A1 P00352 3/20 0.47
HPGD P15428 2/20 0.47
CYP3A4 P08684 2/20 0.45
CYP2C9 P11712 1/20 0.45
TSHR P16473 3/20 0.43
RECQL P46063 2/20 0.43
HSD17B10 Q99714 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PARP1 P09874 1/20 0.43
CYP2C19 P33261 1/20 0.43
BLM P54132 1/20 0.43
PMP22 Q01453 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HSD11B1 P28845 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
ELANE P08246 1/20 0.42

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
SCHEMBL28295258 0.89 POLB (0.45) POLBALDH1A1HPGDCYP3A4CYP2C9
SCHEMBL9247156 0.86 SRD5A2 (0.50) POLBALDH1A1HPGDTSHRTDP1
SCHEMBL27866740 0.83 AKR1C3 (0.53) POLBALDH1A1TSHRTDP1MAPT
Benzoyl Chloride SCHEMBL8166845 0.83 SMN1; SMN2 (0.41) POLBALDH1A1HPGDMAPTSMN1; SMN2
Benzoyl Chloride SCHEMBL8167191 0.83 CES2 (0.45) POLBALDH1A1HPGDSMN1; SMN2NPC1
Benzoyl Chloride SCHEMBL8173965 0.83 MEN1 (0.42) POLBALDH1A1HPGDMAPTSMN1; SMN2
Benzoyl Chloride SCHEMBL8179321 0.83 MAPT (0.45) POLBALDH1A1HPGDMAPTSMN1; SMN2
Benzoyl Chloride SCHEMBL8177754 0.82 POLB (0.39) POLBALDH1A1HPGDCYP3A4CYP2C9
Benzoyl Chloride SCHEMBL8179583 0.82 RECQL (0.46) POLBALDH1A1HPGDRECQLMAPT
Benzoyl Chloride SCHEMBL8166322 0.82 SRD5A2 (0.44) POLBALDH1A1TDP1MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106966995-B The preparation method of cyan colour coupler intermediate 浙江大学 2019-04-26 CN claimed
CN-109206382-A Using DMF as one step of carbon source construct 2-(4- tert-butyl-phenyl) -1,3,4- oxadiazoles method 桂林理工大学 2019-01-15 CN claimed
CN-106220675-B A kind of stannous phenide complex of the ligand containing acylhydrazone and its preparation method and application 衡阳师范学院 2018-11-27 CN claimed
CN-106366118-B A kind of 2- carbonyl -2- phenylacetic acid is to tert-butyl benzoyl hydrazone stannous phenide complex and its preparation method and application 衡阳师范学院 2018-11-27 CN claimed
CN-106220669-B A kind of dialkyl tin complex of the ligand containing acylhydrazone and its preparation method and application 衡阳师范学院 2018-09-07 CN claimed
CN-106220672-B A kind of di-n-butyl tin complex of the ligand containing acylhydrazone and its preparation method and application 衡阳师范学院 2018-09-07 CN claimed
CN-106366118-A 2-carbonyl-2-phenylacetic acid p-tert-butyl-benzoyl hydrazone diphenyl tin complex, preparation method and application thereof 衡阳师范学院 2017-02-01 CN claimed
CN-106366117-A 2-carbonyl-3-phenylpropionic-p-tert-butyl benzoyl hydrazone dibenzyl tin complex, and preparation method and application thereof 衡阳师范学院 2017-02-01 CN claimed
CN-106349279-A 2-carbonyl butyrate tert-butyl benzoyl hydrazone di-n-butyltin complex and preparation method and application thereof 衡阳师范学院 2017-01-25 CN claimed
CN-106349278-A p-tert-butylbenzoylhydrazonodi(2,4-dichlorobenzyl) tin 2-carbonylpropionate complex, and preparation method and application thereof 衡阳师范学院 2017-01-25 CN claimed
CN-106317104-A 2- carbonyl propionic acid p-tert-butyl benzoyl hydrazone stannous phenide complex and preparing method and application thereof 衡阳师范学院 2017-01-11 CN claimed
CN-106220672-A A kind of 2 carbonyl 2 phenylacetic acids are to tert-butyl benzoyl hydrazone di-n-butyl tin coordination compound and its preparation method and application 衡阳师范学院 2016-12-14 CN claimed
CN-106220669-A A kind of 2 carbonyl propionic acids to tert-butyl benzoyl hydrazone two to methyl-benzyl stannum coordination compound and its preparation method and application 衡阳师范学院 2016-12-14 CN claimed
CN-106220675-A A kind of 2 carbonyl butanoic acid are to tert-butyl benzoyl hydrazone stannous phenide coordination compound and its preparation method and application 衡阳师范学院 2016-12-14 CN claimed
CN-103554051-B A kind of electron transport material and synthetic method thereof XI'AN INST. OF MODERN CHEMISTRY (CN) 2015-12-23 CN claimed
CN-103497164-B A kind of anthracene derivant and preparation method thereof XI'AN INST. OF MODERN CHEMISTRY (CN) 2015-12-23 CN claimed
CN-110476730-B Plant growing system and method employing said system OMS投资公司 2022-07-12 CN disclosed
US-10851119-B2 Boron-containing diacylhydrazines INTREXON CORPORATION (US) 2020-12-01 US disclosed
EP-0253468-A2 Six-membered heterocyclic derivatives of N'substituted-N,N'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1988-01-20 EP disclosed
EP-0236618-A2 Insecticidal N'-substituted-N,N'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1987-09-16 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10851119-B2 Boron-containing diacylhydrazines CD22, BRDT, BCR POLB 4516/4885ALDH1A1 2724/4885HPGD 3442/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.