SCHEMBL768569

SCHEMBL768569

Cc1cc([N+](=O)[O-])cc(C)c1Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.60
TSHR P16473 5/20 0.56
TDP1 Q9NUW8 4/20 0.56
GPR35 Q9HC97 2/20 0.53
CYP3A4 P08684 3/20 0.52
CYP19A1 P11511 1/20 0.48
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HSD17B10 Q99714 2/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45
ACHE P22303 2/20 0.44
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 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
SCHEMBL6771134 0.89 ALDH1A1 (0.72) ALDH1A1TSHRTDP1GPR35CYP3A4
SCHEMBL30435223 0.87 ALDH1A1 (0.61) ALDH1A1TSHRTDP1GPR35CYP3A4
SCHEMBL9452637 0.87 ALDH1A1 (0.61) ALDH1A1TSHRTDP1GPR35CYP3A4
SCHEMBL26694938 0.86 ALDH1A1 (0.50) ALDH1A1TSHRTDP1GPR35CYP3A4
SCHEMBL27725655 0.86 ALDH1A1 (0.55) ALDH1A1TSHRTDP1GPR35CYP3A4
SCHEMBL28291579 0.86 ALDH1A1 (0.50) ALDH1A1TSHRTDP1GPR35CYP3A4
SCHEMBL8791047 0.81 ALDH1A1 (0.46) ALDH1A1TSHRTDP1GPR35CYP3A4
SCHEMBL28180984 0.81 ALDH1A1 (0.46) ALDH1A1TSHRTDP1GPR35CYP3A4
SCHEMBL9944130 0.81 ALDH1A1 (0.46) ALDH1A1TSHRTDP1GPR35CYP3A4
SCHEMBL6436847 0.81 VCAM1 (0.56) ALDH1A1TSHRTDP1GPR35CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0687263-B1 PROCESS FOR PREPARING (TRANS)-6- [2-(SUBSTITUTED-PYRROL-1-YL)ALKYL]PYRAN-2-ONE INHIBITORS OF CHOLESTEROL SYNTHESIS WARNER LAMBERT CO (US) 1997-07-30 EP claimed
EP-0330172-B1 Improved process for trans-6-[2-(substituted-pyrol-1-yl)alkyl]pyran-2-one inhibitors of cholesterol synthesis WARNER LAMBERT CO (US) 1994-08-10 EP claimed
CN-120682158-A Nitrogen-containing heterocyclic compound, and preparation method and application thereof 山东阳谷华泰化工股份有限公司 2025-09-23 CN disclosed
US-10869934-B2 Antiproliferative compounds and conjugates made therefrom BRISTOL-MYERS SQUIBB COMPANY (US) 2020-12-22 US disclosed
US-10398783-B2 Antiproliferative compounds and conjugates made therefrom BRISTOL-MYERS SQUIBB COMPANY (US) 2019-09-03 US disclosed
WO-2018075842-A1 CONDENSED BENZODIAZEPINE DERIVATIVES AND CONJUGATES MADE THEREFROM BRISTOL-MYERS SQUIBB COMPANY (US) 2018-04-26 WO disclosed
US-20180110873-A1 ANTIPROLIFERATIVE COMPOUNDS AND CONJUGATES MADE THEREFROM BRISTOL-MYERS SQUIBB COMPANY 2018-04-26 US disclosed
US-20180110873-A1 ANTIPROLIFERATIVE COMPOUNDS AND CONJUGATES MADE THEREFROM BRISTOL-MYERS SQUIBB COMPANY 2018-04-26 US disclosed
EP-2066673-B1 TRICYCLIC COMPOUNDS AND ITS USE AS TYROSINE KINASE MODULATORS CHEMBRIDGE CORP (US) 2016-12-28 EP disclosed
US-9290503-B2 Tricyclic compound derivatives useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2016-03-22 US disclosed
US-9290503-B2 Tricyclic compound derivatives useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2016-03-22 US disclosed
US-4426385-A Insecticidal bicyclooxyphenyl ureas UNION CARBIDE CORPORATION (US) 1984-01-17 US disclosed
EP-0050321-A2 Novel bicyclooxyphenyl ureas, process for their preparation and pesticides containing them UNION CARBIDE CORPORATION (US) 1982-04-28 EP disclosed
US-4287372-A Preparation of nitro-substituted diphenyl ethers UOP INC. (US) 1981-09-01 US disclosed
US-4228103-A Effecting condensation of nitrohaloarene and formyl derivative of a primary aromatic amine with alkali metal hydroxide MONSANTO COMPANY (US) 1980-10-14 US disclosed
US-4209463-A Promoting the formation of nitrodiarylamines from nitrohaloarenes, activated aryl amines and sodium carbonates MONSANTO COMPANY (US) 1980-06-24 US disclosed
US-4196146-A Making nitrodiarylamines from formyl derivatives of aromatic amines and nitrohaloarenes by admixing with certain aqueous salt solutions MONSANTO COMPANY (US) 1980-04-01 US disclosed
US-4187248-A FORMANILIDE MONSANTO COMPANY (US) 1980-02-05 US disclosed
US-4187249-A COMPOUNDS OF POTASSIUM, CESIUM, OR RUBIDIUM MONSANTO COMPANY (US) 1980-02-05 US disclosed
US-4140716-A Process for making an amide of formic acid and forming nitrodiarylamine therefrom MONSANTO COMPANY (US) 1979-02-20 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-20180110873-A1 ANTIPROLIFERATIVE COMPOUNDS AND CONJUGATES MADE THEREFROM MKI67, HDGF, PCLAF ALDH1A1 314/4885TSHR 1412/4885TDP1 2711/4885
US-10869934-B2 Antiproliferative compounds and conjugates made therefrom MKI67, HDGF, PCLAF ALDH1A1 314/4885TSHR 1412/4885TDP1 2711/4885
US-10398783-B2 Antiproliferative compounds and conjugates made therefrom MKI67, HDGF, PCLAF ALDH1A1 314/4885TSHR 1412/4885TDP1 2711/4885

“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.