SCHEMBL5166507

SCHEMBL5166507

O=C1CCCCN1c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.57
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
RAB9A P51151 1/20 0.52
AKR1C3 P42330 2/20 0.51
ALDH1A1 P00352 3/20 0.50
LMNA P02545 2/20 0.48
HPGD P15428 1/20 0.48
HRH3 Q9Y5N1 1/20 0.47
POLB P06746 2/20 0.47
APEX1 P27695 1/20 0.47
CASP6 P55212 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
SIRT6 Q8N6T7 2/20 0.46
ADRB1 P08588 1/20 0.46

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
SCHEMBL85664 0.98 MAPT (0.60) MAPTMEN1KMT2ARAB9AAKR1C3
SCHEMBL29929946 0.95 MEN1 (0.56) MAPTMEN1KMT2ARAB9AAKR1C3
SCHEMBL77999 0.95 MEN1 (0.56) MAPTMEN1KMT2ARAB9AAKR1C3
SCHEMBL11183530 0.88 MAPT (0.53) MAPTMEN1KMT2ARAB9AALDH1A1
SCHEMBL17206015 0.85 MAPT (0.43) MAPTMEN1KMT2ARAB9AAKR1C3
SCHEMBL8317379 0.82 MAPT (0.56) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL85661 0.81 KMT2A (0.57) MAPTMEN1KMT2ARAB9AALDH1A1
SCHEMBL7549606 0.81 MAPT (0.58) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL30962697 0.80 SIRT6 (0.62) MAPTMEN1KMT2ARAB9AALDH1A1
SCHEMBL85229 0.78 MAPT (0.49) MAPTMEN1KMT2ARAB9AAKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110615756-A 1- (4-nitrophenyl) piperidine-2-ketone and synthetic method and application thereof 南京红杉生物科技有限公司 2019-12-27 CN claimed
WO-2015162551-A1 PROCESS FOR THE PREPARATION OF APIXABAN MYLAN LABORATORIES LTD (IN) 2015-10-29 WO claimed
CN-103159670-A Synthetic method of apixaban intermediate 1-(4-nitrobenzophenone)-2-piperidone LANZHOU CHEM PHYS INST 2013-06-19 CN claimed
CN-120483910-A Apixaban intermediate 5, 6-dihydro-3- (4-morpholinyl) -1- (4-nitrophenyl) -2 (1H) -piperidone and synthetic method thereof 成都化润药业有限公司 2025-08-15 CN disclosed
CN-116375703-B Synthesis process of apixaban 常州制药厂有限公司 2025-01-17 CN disclosed
CN-115215816-B Synthesis method of lactam compound 普济生物科技(台州)有限公司 2024-02-02 CN disclosed
CN-116253675-B Synthesis method of N-substituted-2-piperidone 山东信谊制药有限公司 2023-07-25 CN disclosed
CN-116375703-A Synthesis process of apixaban 常州制药厂有限公司 2023-07-04 CN disclosed
CN-116253675-A Synthesis method of N-substituted-2-piperidone 山东信谊制药有限公司 2023-06-13 CN disclosed
CN-115215816-A Synthesis method of lactam compound 普济生物科技(台州)有限公司 2022-10-21 CN disclosed
WO-2022218348-A1 METHOD FOR SYNTHESIZING LACTAM COMPOUNDS Seasons Biotechnology (Taizhou) Co., Ltd. (CN) 2022-10-20 WO disclosed
US-20040097550-A1 Biurethane derivatives MERCK PATENT GMBH (DE) 2004-05-20 US disclosed
US-20040087582-A1 Phenyl derivatives MERCK PATENT GESELLSCHAFT (DE) 2004-05-06 US disclosed
EP-1385818-A2 BIURETHANE DERIVATIVES MERCK PATENT GmbH (DE) 2004-02-04 EP disclosed
EP-1351938-A1 PHENYL DERIVATIVES MERCK PATENT GmbH (DE) 2003-10-15 EP disclosed
US-6509358-B2 For therapy of metabolic disorders related to insulin resistance or hyperglycemia, typically associated with obesity or glucose intolerance), atherosclerosis, gastrointestinal disorders, neurogenic inflammation, glaucoma WYETH 2003-01-21 US disclosed
WO-2002074735-A2 BIURETHANE DERIVATIVES MERCK PATENT GMBH (DE) 2002-09-26 WO disclosed
WO-2002057236-A1 PHENYL DERIVATIVES MERCK PATENT GMBH (DE) 2002-07-25 WO disclosed
US-20020022641-A1 Piperidino-phenyl amino squarate and thiadiazole dioxide beta-3 adrenergic receptor agonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-02-21 US disclosed
WO-2002006230-A2 PIPERIDINO-PHENYL AMINO SQUARATE AND THIADIAZOLE DIOXIDE BETA-3 ADRENERGIC RECEPTOR AGONISTS AMERICAN HOME PROD (US) 2002-01-24 WO 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 (3 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-20040097550-A1 Biurethane derivatives F2, F11, BRCA1 MAPT 3798/4885MEN1 871/4885KMT2A 3737/4885
US-20040087582-A1 Phenyl derivatives F2, F11, SERPINC1 MAPT 4360/4885MEN1 2997/4885KMT2A 2252/4885
US-20020022641-A1 Piperidino-phenyl amino squarate and thiadiazole dioxide beta-3 adrenergic receptor agonists ADRB1, ADRB3, GPR119 MAPT 1596/4885MEN1 3600/4885KMT2A 3288/4885

“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.