SCHEMBL28993262

SCHEMBL28993262

CCCCc1cc2ccc([N+](=O)[O-])cc2[nH]1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
RIPK1 Q13546 2/20 0.50
CCNT1 O60563 1/20 0.50
CDK9 P50750 1/20 0.50
MAPT P10636 3/20 0.48
LMNA P02545 2/20 0.48
ALDH1A1 P00352 1/20 0.48
KCNJ1 P48048 1/20 0.48
POLB P06746 2/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPBWR1 P48145 2/20 0.46
PKM P14618 1/20 0.44
HRH4 Q9H3N8 1/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX15 P16050 1/20 0.43
NOS1 P29475 1/20 0.43
ESPL1 Q14674 1/20 0.43
GRIA1 P42261 1/20 0.43

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
SCHEMBL9486575 0.89 CYP19A1 (0.49) KDM4ERIPK1CCNT1CDK9MAPT
SCHEMBL9053698 0.85 NPBWR1 (0.52) KDM4ERIPK1CCNT1CDK9MAPT
SCHEMBL28923795 0.84 KCNH2 (0.50) KDM4ERIPK1CCNT1CDK9MAPT
SCHEMBL7807147 0.79 KDM4E (0.55) KDM4ERIPK1CCNT1CDK9MAPT
SCHEMBL28784277 0.77 MAPT (0.42) KDM4EMAPTLMNAALDH1A1KCNJ1
SCHEMBL17141271 0.76 MTNR1A (0.48) RIPK1CCNT1CDK9MAPTLMNA
SCHEMBL7608611 0.75 KDM4E (0.85) KDM4ERIPK1CCNT1CDK9MAPT
SCHEMBL5171836 0.75 ALDH1A1 (0.43) KDM4ERIPK1MAPTLMNAALDH1A1
SCHEMBL8802605 0.74 CYP19A1 (0.49) KDM4EMAPTLMNAALDH1A1KCNJ1
SCHEMBL1122279 0.74 RIPK1 (0.60) KDM4ERIPK1MAPTLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116023280-B Synthesis method of 2-amino-4-nitrophenol 湖北丽康源化工有限公司 2024-12-13 CN disclosed
CN-116023280-A Synthesis method of 2-amino-4-nitrophenol 湖北丽康源化工有限公司 2023-04-28 CN disclosed
CN-112851532-A Preparation method of 2-amino-4-nitrophenol 九江善水科技股份有限公司 2021-05-28 CN disclosed