SCHEMBL517802

SCHEMBL517802

FC(F)(F)N1CCNCC1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 3/20 0.37
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
HTR3E A5X5Y0 1/20 0.32
HTR3B O95264 1/20 0.32
HTR1D P28221 1/20 0.32
HTR2C P28335 1/20 0.32
HTR3A P46098 1/20 0.32
HTR3D Q70Z44 1/20 0.32
HTR3C Q8WXA8 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL26646496 0.97 ADRB1 (0.35) ADRB1ALDH1A1LMNAHTR3EHTR3B
Hydrochloric Acid SCHEMBL12818396 0.97 ALDH1A1 (0.37) ADRB1ALDH1A1LMNAHTR3EHTR3B
Hydrazine SCHEMBL27569857 0.94 ADRB1 (0.34) ADRB1ALDH1A1LMNAHTR3EHTR3B
Benzene SCHEMBL27534755 0.92 SIGMAR1 (0.39) ADRB1ALDH1A1HTR3EHTR3BHTR1D
Propane SCHEMBL28275423 0.89 ADRB1 (0.32) ADRB1
SCHEMBL19343650 0.89 CXCR4 (0.35) ADRB1ALDH1A1
SCHEMBL26645919 0.87 ADRB1 (0.31) ADRB1
SCHEMBL13555457 0.82
Pyridine SCHEMBL28115254 0.80 PLD1 (0.38) ADRB1ALDH1A1HTR3EHTR3BHTR1D
SCHEMBL29649161 0.77 ADRB1 (0.34) ADRB1ALDH1A1LMNAHTR3EHTR3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12502386-B2 Nitrogen-containing heterocyclic compound and use thereof Shanghai Shijiang Biotechnology Co., Ltd. (CN) 2025-12-23 US claimed
US-20250197415-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND USE THEREOF SHANGHAI SHIJIANG BIOTECHNOLOGY CO., LTD (CN) 2025-06-19 US claimed
US-20250197389-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND SHANGHAI SHIJIANG BIOTECHNOLOGY CO., LTD (CN) 2025-06-19 US claimed
CN-110156772-A Heterocyclic compound, application thereof and pharmaceutical composition containing same 苏州信诺维医药科技有限公司 2019-08-23 CN claimed
CN-104926801-B Substituted azetidine analog derivative, the pharmaceutical composition containing it and its application in antitumor 浙江大学 2019-06-04 CN claimed
CN-109496211-A A kind of piperazine derivative of anti-candida albicans and the preparation method and application thereof 华南农业大学 2019-03-19 CN claimed
CN-109384680-A A kind of preparation method of flibanserin intermediate 广州朗圣药业有限公司 2019-02-26 CN claimed
CN-108017659-A Benzimidazole and thiazole carboxamides class compound and its application 沈阳药科大学 2018-05-11 CN claimed
CN-107200711-A A kind of new technology for preparing flibanserin 葵花药业集团北京药物研究院有限公司 2017-09-26 CN claimed
CN-106966991-A A kind of new technology for preparing flibanserin 葵花药业集团北京药物研究院有限公司 2017-07-21 CN claimed
CN-106699670-A Benzimidazolyl piperazine compounds, preparation method thereof and pharmaceutical composition 辽宁艾美生物医药产业有限公司 2017-05-24 CN claimed
CN-104046246-B The chemical-mechanical planarization of tungsten-containing substrate 气体产品与化学公司 2016-06-15 CN claimed
CN-103797022-B The method of purification of betulonic acid and Boc-Methionin betulonic acid, and utilize bridged piperazine derivatives to prepare the methodology of organic synthesis of betulonic acid acid amides KOREA INSTITUTE OF ENERGY RESEARCH (KR) 2016-04-20 CN claimed
CN-103797022-A Method of purifying betulonic acid and boc-lysinated betulonic acid, organic synthesis method of preparing piperazine betulonic acid amide by using a piperazine derivative KOREA ENERGY RESEARCH INST 2014-05-14 CN claimed
CN-102060712-A Method for preparing 4-trifluoromethylphenyl piperazine JUNKAI TIANJIN CHEMICAL CO LTD 2011-05-18 CN claimed
EP-2300469-A2 FUSED NITROGEN CONTAINING HETEROCYCLES AND COMPOSITIONS THEREOF AS KINASE INHIBITORS IRM LLC (BM) 2011-03-30 EP claimed
WO-2009140128-A2 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-11-19 WO claimed
US-12502386-B2 Nitrogen-containing heterocyclic compound and use thereof Shanghai Shijiang Biotechnology Co., Ltd. (CN) 2025-12-23 US disclosed
EP-0034249-A2 New naphthimidazole and naphthoxazole derivatives, their preparation, and their use in pharmaceuticals GRUPPO LEPETIT S.P.A. (IT) 1981-08-26 EP disclosed
US-4107437-A SEDATIVES, ANTIARRHYTHMIA AGENTS PARCOR (FR) 1978-08-15 US 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-20250197389-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND PPIF, PIN1, NME4 ADRB1 4671/4885ALDH1A1 3141/4885LMNA 2301/4885
US-20250197415-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND USE THEREOF UHRF1, NNMT, EHMT1 ADRB1 3508/4885ALDH1A1 956/4885LMNA 4217/4885
US-12502386-B2 Nitrogen-containing heterocyclic compound and use thereof UHRF1, NNMT, EHMT1 ADRB1 3508/4885ALDH1A1 956/4885LMNA 4217/4885

“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.