SCHEMBL728757

SCHEMBL728757

O=C(Cl)c1cc(C(=O)Cl)cc([N+](=O)[O-])c1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.66
TSHR P16473 2/20 0.66
CYP3A4 P08684 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
CES1 P23141 2/20 0.48
CES2 O00748 1/20 0.48
TP53 P04637 1/20 0.47
CYP19A1 P11511 1/20 0.46
ATM Q13315 1/20 0.46
ALOX5 P09917 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 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
SCHEMBL54880 0.95 ALDH1A1 (0.66) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL7596117 0.92 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL12501661 0.92 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL30917331 0.92 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL9798039 0.90 CYP3A4 (0.75) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL13307462 0.90 ALDH1A1 (0.56) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL28815673 0.88 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL11689544 0.88 ALDH1A1 (0.58) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL1363427 0.86 ALDH1A1 (0.56) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1
SCHEMBL1928079 0.86 ALDH1A1 (0.56) ALDH1A1TSHRCYP3A4SMN1; SMN2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118685993-B Antibacterial breathable fabric and preparation process thereof 广东健业纺织集团有限公司 2025-02-18 CN claimed
CN-118772601-A Preparation method of nano silicon dioxide composite material 中科国京(合肥)控股有限公司 2024-10-15 CN claimed
CN-118685993-A Antibacterial breathable fabric and preparation process thereof 广东健业纺织集团有限公司 2024-09-24 CN claimed
CN-112713361-A Composite lithium-sulfur battery diaphragm and preparation method and application thereof 中国石油化工股份有限公司 2021-04-27 CN claimed
EP-4745634-A1 COMPOSITION, OPTICALLY ANISOTROPIC FILM, AND COMPOUND FUJIFILM Corporation (JP) 2026-05-20 EP disclosed
EP-3985001-B1 PHARMACEUTICAL COMPOSITION FOR USE IN TREATING A CANCER SERVIER LAB (FR) 2026-04-29 EP disclosed
US-20260092215-A1 COMPOSITION, OPTICALLY ANISOTROPIC FILM, AND COMPOUND FUJIFILM CORPORATION (JP) 2026-04-02 US disclosed
WO-2025045826-A1 COMPOUNDS FOR ACTIVATION OF FGFR1 SIGNALING THE CULTIVATED B. GMBH (DE) 2025-03-06 WO disclosed
CN-118685993-B Antibacterial breathable fabric and preparation process thereof 广东健业纺织集团有限公司 2025-02-18 CN disclosed
WO-2025013902-A1 COMPOSITION, OPTICALLY ANISOTROPIC FILM, AND COMPOUND 富士フイルム株式会社 2025-01-16 WO disclosed
US-20240425445-A1 TRISAMIDE COMPOUNDS AND COMPOSITIONS COMPRISING THE SAME MILLIKEN & CO (US) 2024-12-26 US disclosed
CN-221965301-U Device and system for continuously producing 5-nitro dimethyl isophthalic acid by micro-channel 成都艾必克医药科技有限公司 2024-11-08 CN disclosed
US-4108890-A Nitro or amino phenylenebis(carbonylimino)dinaphthalenetrisulfonic compounds as complement inhibitors AMERICAN CYANAMID COMPANY (US) 1978-08-22 US disclosed
US-4102917-A COMPLEMENT INHIBITORS AMERICAN CYANAMID COMPANY (US) 1978-07-25 US disclosed
US-4102918-A Anionic phenylcarboxamide complement inhibitors AMERICAN CYANAMID COMPANY (US) 1978-07-25 US disclosed
US-4087613-A 1,3,5- Or 1,3,6-naphthalenetriyltris(sulfonylimino)aryl acids and salts AMERICAN CYANAMID COMPANY (US) 1978-05-02 US disclosed
US-4051176-A COMPLEMENT INHIBITORS AMERICAN CYANAMID COMPANY (US) 1977-09-27 US disclosed
US-4051123-A Sulfonic-acid-group containing disazo dyestuffs CIBA-GEIGY AG (CH) 1977-09-27 US disclosed
US-3945989-A Fluoro triazine containing water insoluble azo dyestuff CIBA-GEIGY AG (CH) 1976-03-23 US disclosed
US-3931142-A Heterocyclic containing disazo compounds CIBA-GEIGY AG (CH) 1976-01-06 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-20240425445-A1 TRISAMIDE COMPOUNDS AND COMPOSITIONS COMPRISING THE SAME PTAR1, TIPRL, TCOF1 ALDH1A1 4713/4885TSHR 2279/4885CYP3A4 2357/4885
US-20260092215-A1 COMPOSITION, OPTICALLY ANISOTROPIC FILM, AND COMPOUND SMC1A, SMC2, SMC3 ALDH1A1 3561/4885TSHR 3451/4885CYP3A4 4330/4885

“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.