SCHEMBL3396060

SCHEMBL3396060

O=C(O)Cc1cc(F)ccc1[N+](=O)[O-]

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.55
TDP1 Q9NUW8 2/20 0.53
ATM Q13315 1/20 0.53
SNCA P37840 4/20 0.49
TSHR P16473 1/20 0.45
CASP6 P55212 1/20 0.42
ALDH1A1 P00352 4/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 4/20 0.42
AGBL2 Q5U5Z8 1/20 0.42
MAPK1 P28482 1/20 0.42
TTR P02766 1/20 0.40
MEN1 O00255 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL6186718 0.89 SNCA (0.50) CYP1A2TDP1ATMSNCAALDH1A1
SCHEMBL2989584 0.87 CYP1A2 (0.69) CYP1A2TDP1ATMSNCATSHR
SCHEMBL2989578 0.87 CYP1A2 (0.69) CYP1A2TDP1ATMSNCATSHR
SCHEMBL23200508 0.85 ATM (0.51) CYP1A2TDP1ATMSNCAALDH1A1
SCHEMBL10509624 0.85 TDP1 (0.51) CYP1A2TDP1ATMSNCACASP6
SCHEMBL3010413 0.85 ATM (0.51) CYP1A2TDP1ATMSNCAALDH1A1
SCHEMBL10509627 0.85 TDP1 (0.51) CYP1A2TDP1ATMSNCACASP6
SCHEMBL11630295 0.84 NPC1 (0.56) TDP1ATMSNCATSHRCASP6
SCHEMBL9651648 0.83 MAOA (0.59) TDP1ATMSNCAALDH1A1KMT2A
SCHEMBL1028874 0.81 PDGFRB (0.56) CYP1A2TDP1ATMSNCAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104447347-A Preparation method for sunitinibmalate intermediate PARLING SHANGHAI PHARMATECH CO LTD 2015-03-25 CN claimed
WO-2026098560-A2 BENZENE-CONTAINING POLYCYCLIC DERIVATIVE MODULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2026-05-15 WO disclosed
US-20250368647-A1 NITROGEN CONTAINING CONDENSED 2,3-DIHYDROQUINAZOLINONE COMPOUNDS AS NAV1.8 INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2025-12-04 US disclosed
CN-116903471-B Monofluoro/difluoro oxo allyl ester compound and preparation method thereof 上海应用技术大学 2025-05-30 CN disclosed
WO-2025077825-A1 METHODS AND COMPOSITIONS FOR TREATING CARDIO-PULMONARY DISORDERS FAUNA BIO INCORPORATED (US) 2025-04-17 WO disclosed
EP-4536660-A1 NITROGEN CONTAINING CONDENSED 2,3-DIHYDROQUINAZOLINONE COMPOUNDS AS NAV1.8 INHIBITORS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2025-04-16 EP disclosed
US-20250092014-A1 COMPOUNDS AND METHODS OF ACTIVATING LIPOPROTEIN LIPASE METREA BIOSCIENCES INC (US) 2025-03-20 US disclosed
CN-119325476-A Nitrogen-containing condensed 2, 3-dihydroquinazolinone compounds as NAV1.8 inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2025-01-17 CN disclosed
US-20240246977-A1 DEGRADATION OF BRUTON'S TYROSINE KINASE (BTK) BY CONJUGATION OF BTK INHIBITORS WITH E3 LIGASE LIGAND AND METHOD OF USE BEONE MEDICINES I GMBH (CH) 2024-07-25 US disclosed
CN-112638864-B Traceless reductive cleavable linker molecules for peptide purification 格瑞罗斯普罗泰恩科技公司 2024-03-08 CN disclosed
WO-2007104664-A1 SPIROINDOLINONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-09-20 WO disclosed
US-20070213341-A1 Spiroindolinone derivatives CHEN LI 2007-09-13 US disclosed
US-7101886-B2 Phenylalkyl and pyridylalkyl piperazine derivatives WARNER LAMBERT COMPANY (US) 2006-09-05 US disclosed
EP-1562919-A1 PHENYLALKYL AND PYRIDYLALKYL PIPERAZINE DERIVATIVES Warner-Lambert Company LLC (US) 2005-08-17 EP disclosed
EP-1546145-A1 HETEROCYCLIC SUBSTITUTED PIPERAZINES FOR THE TREATMENT OF SCHIZOPHRENIA WARNER-LAMBERT COMPANY LLC (US) 2005-06-29 EP disclosed
US-20040186108-A1 Phenylalkyl and pyridylalkyl piperazine derivatives CHO STEPHEN SUNG YONG (US) 2004-09-23 US disclosed
WO-2004041793-A1 PHENYLALKYL AND PYRIDYLALKYL PIPERAZINE DERIVATIVES WARNER-LAMBERT COMPANY LLC (US) 2004-05-21 WO disclosed
WO-2004029048-A1 HETEROCYCLIC SUBSTITUTED PIPERAZINES FOR THE TREATMENT OF SCHIZOPHRENIA WARNER-LAMBERT COMPANY LLC (US) 2004-04-08 WO disclosed
US-20040067960-A1 Heterocyclic substituted piperazines for the treatment of schizophrenia DAVIS JAMIE MARIE (US) 2004-04-08 US disclosed
US-4160032-A Oxindoles as sleep-inducers SANDOZ, INC. (US) 1979-07-03 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 (6 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-20040186108-A1 Phenylalkyl and pyridylalkyl piperazine derivatives CNR1, CNR2, PMP22 CYP1A2 29/4885TDP1 1289/4885ATM 3038/4885
US-20250368647-A1 NITROGEN CONTAINING CONDENSED 2,3-DIHYDROQUINAZOLINONE COMPOUNDS AS NAV1.8 INHIBITORS SCN8A, SCN2A, SCN5A CYP1A2 1602/4885TDP1 3545/4885ATM 3660/4885
US-20070213341-A1 Spiroindolinone derivatives MKI67, PKD1, RCC2 CYP1A2 393/4885TDP1 3690/4885ATM 2027/4885
US-20250092014-A1 COMPOUNDS AND METHODS OF ACTIVATING LIPOPROTEIN LIPASE LPL, LIPA, PNLIP CYP1A2 973/4885TDP1 301/4885ATM 796/4885
US-20240246977-A1 DEGRADATION OF BRUTON'S TYROSINE KINASE (BTK) BY CONJUGATION OF BTK INHIBITORS WITH E3 LIGASE LIGAND AND METHOD OF USE BTK, CBL, SYK CYP1A2 4471/4885TDP1 1237/4885ATM 1075/4885
US-20040067960-A1 Heterocyclic substituted piperazines for the treatment of schizophrenia HTR2C, CNR1, HTR2A CYP1A2 87/4885TDP1 4139/4885ATM 3903/4885

“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.