SCHEMBL512092

SCHEMBL512092

COc1ccc([N+](=O)[O-])cc1Cl

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.67
SMN1; SMN2 Q16637 5/20 0.67
HPGD P15428 3/20 0.67
RAB9A P51151 2/20 0.67
NPC1 O15118 1/20 0.67
CYP1A2 P05177 1/20 0.67
CYP3A4 P08684 1/20 0.67
CYP2D6 P10635 1/20 0.67
CYP2C9 P11712 1/20 0.67
CYP2C19 P33261 1/20 0.67
TDP1 Q9NUW8 1/20 0.64
LMNA P02545 6/20 0.63
HTT P42858 4/20 0.61
HSD17B10 Q99714 1/20 0.60
ALDH1A1 P00352 4/20 0.58
MAPK1 P28482 4/20 0.58
KMT2A Q03164 3/20 0.58
MEN1 O00255 2/20 0.58
PDE7A Q13946 1/20 0.58
NPSR1 Q6W5P4 2/20 0.55

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
SCHEMBL29435299 1.00 MAPT (0.67) MAPTSMN1; SMN2HPGDRAB9ANPC1
SCHEMBL57125 0.87 HTT (0.68) MAPTSMN1; SMN2HPGDRAB9ANPC1
SCHEMBL11511746 0.85 PDE7A (0.71) MAPTSMN1; SMN2HPGDRAB9ANPC1
SCHEMBL10965789 0.83 MAPT (0.61) MAPTSMN1; SMN2HPGDRAB9ANPC1
SCHEMBL527567 0.82 HTT (0.72) MAPTSMN1; SMN2HPGDRAB9ANPC1
SCHEMBL29441283 0.82 HTT (0.72) MAPTSMN1; SMN2HPGDRAB9ANPC1
SCHEMBL22069645 0.82 MAPT (0.67) MAPTSMN1; SMN2HPGDRAB9ANPC1
SCHEMBL1332216 0.82 MAPT (0.60) MAPTSMN1; SMN2HPGDRAB9ANPC1
SCHEMBL14477748 0.82 HSD17B10 (0.56) MAPTSMN1; SMN2HPGDRAB9ANPC1
SCHEMBL2766450 0.82 MAPT (0.63) MAPTSMN1; SMN2HPGDRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114478291-A Preparation method of monomer diamine compound of polyimide 西安爱德克美新材料有限公司 2022-05-13 CN claimed
CN-103172536-A Preparation method of 4-amino-2,6-dichloro-alpha-(4-chlorphenyl) benzyl cyanide CHANGZHOU YABANG QH PHARMACHEM CO LTD 2013-06-26 CN claimed
CN-117362642-A Polyimide with high Tg and low dielectric constant, and preparation method and application thereof 中国科学院福建物质结构研究所 2024-01-09 CN disclosed
CN-114478291-A Preparation method of monomer diamine compound of polyimide 西安爱德克美新材料有限公司 2022-05-13 CN disclosed
CN-114478291-A Preparation method of monomer diamine compound of polyimide 西安爱德克美新材料有限公司 2022-05-13 CN disclosed
CN-110088092-A Compounds, methods of obtaining compounds, pharmaceutical compositions, uses of compounds and methods of treating psychiatric and/or sleep disorders 艾奇实验室制药有限公司 2019-08-02 CN disclosed
US-20150336975-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2015-11-26 US disclosed
EP-2459197-B1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL MYERS SQUIBB CO (US) 2015-10-14 EP disclosed
US-20150152089-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION BRISTOL MYERS SQUIBB CO (US) 2015-06-04 US disclosed
CN-102548557-B Compounds for reducing beta-amyloid production BRISTOL MYERS SQUIBB CO 2014-12-24 CN disclosed
CN-103130657-B Synthetic method of 2-chloro-4-aminophenol JIANGSU FLAG CHEMICAL INDUSTRY CO LTD 2014-12-10 CN disclosed
EP-0325892-A2 Process for the preparation of halogenated primary amines CIBA-GEIGY AG (CH) 1989-08-02 EP disclosed
EP-0281242-A1 Beta-alkylmelatonins ELI LILLY AND COMPANY (US) 1988-09-07 EP disclosed
CN-88100478-A alkyl melatonin 1988-08-17 CN disclosed
EP-0076220-B1 PROCESS FOR THE HYDROLYSIS OF ARYL ALIPHATIC ETHERS RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1985-08-07 EP disclosed
EP-0076220-A1 Process for the hydrolysis of aryl aliphatic ethers RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1983-04-06 EP disclosed
US-4225611-A TREATMENT OF ULCEROUS GASTRO-DUODENAL DISORDERS CHOAY S.A. (FR) 1980-09-30 US disclosed
US-4126626-A DYES, POLYESTERS CIBA-GEIGY CORPORATION (US) 1978-11-21 US disclosed
US-4059627-A HYDROGENATION OF CHLORINATED NITRO AROMATIC, NOBLE METAL CATALYST, THIOETHER BAYER AKTIENGESELLSCHAFT (DT) 1977-11-22 US disclosed
US-3989756-A RANEY CATALYST, DEHALOGENATION INHIBITOR NIPPON KAYAKU KABUSHIKI KAISHA (JA) 1976-11-02 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 (2 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-20150152089-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION APP, BACE1, IAPP MAPT 15/4885SMN1; SMN2 760/4885HPGD 586/4885
US-20150336975-A1 COMPOUNDS FOR THE REDUCTION OF BETA-AMYLOID PRODUCTION APP, BACE1, IAPP MAPT 15/4885SMN1; SMN2 760/4885HPGD 586/4885

“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.