SCHEMBL155113

SCHEMBL155113

COc1cc(Br)ccc1N

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.61
CYP3A4 P08684 3/20 0.61
TDP1 Q9NUW8 3/20 0.61
TSHR P16473 1/20 0.61
HSD17B10 Q99714 1/20 0.61
APP P05067 3/20 0.58
POLB P06746 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
MAPT P10636 1/20 0.53
HTT P42858 1/20 0.50
ADRA2B P18089 1/20 0.48
PTGS1 P23219 1/20 0.48
GAA P10253 3/20 0.45
MGAM O43451 1/20 0.45
SI P14410 1/20 0.45
MGAM2 Q2M2H8 1/20 0.45
SLC2A1 P11166 1/20 0.42
KDM4E B2RXH2 1/20 0.42

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
Hydrochloric Acid SCHEMBL28039298 0.98 ALDH1A1 (0.61) ALDH1A1CYP3A4TDP1TSHRHSD17B10
Bromide SCHEMBL7931348 0.98 ALDH1A1 (0.59) ALDH1A1CYP3A4TDP1TSHRHSD17B10
SCHEMBL30184653 0.85 ALDH1A1 (0.46) ALDH1A1CYP3A4TDP1TSHRHSD17B10
SCHEMBL29689196 0.82 ALDH1A1 (0.59) ALDH1A1CYP3A4TDP1TSHRHSD17B10
SCHEMBL111151 0.82 ALDH1A1 (0.59) ALDH1A1CYP3A4TDP1TSHRHSD17B10
SCHEMBL1299012 0.81 ALDH1A1 (0.52) ALDH1A1CYP3A4TDP1TSHRHSD17B10
SCHEMBL205027 0.79 GAA (0.47) ALDH1A1CYP3A4TDP1TSHRHSD17B10
SCHEMBL20509 0.78 CA2 (0.56) ALDH1A1CYP3A4TDP1TSHRAPP
SCHEMBL29419589 0.78 CA2 (0.56) ALDH1A1CYP3A4TDP1TSHRAPP
SCHEMBL25033177 0.78 ALDH1A1 (0.43) ALDH1A1CYP3A4TDP1TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117304193-A Organic purple light absorbing material based on TB-naphthalimide derivative, and preparation and application thereof 江苏师范大学 2023-12-29 CN claimed
CN-117186456-A Preparation and application of organic UVB absorbing film based on TB-triphenylamine derivative 江苏师范大学 2023-12-08 CN claimed
CN-116769205-A Preparation method and application of anti-blue light film based on TB-thiophene malononitrile derivative 江苏师范大学 2023-09-19 CN claimed
CN-111574414-A Synthesis method of 4-bromo-2-methoxybenzenesulfonyl chloride 上海毕得医药科技有限公司 2020-08-25 CN claimed
CN-103450078-B 2-aryl-6-(2-aryl acetylenyl) cinolineand and preparation method thereof UNIV LUOYANG NORMAL 2015-04-22 CN claimed
CN-103435542-B 2-biaryl-6-arylquinazoline and preparation method thereof UNIV LUOYANG NORMAL 2015-04-01 CN claimed
CN-104356002-A Preparation process of impurities contained in expectorant drug bromhexine hydrochloride UNIV HEBEI MEDICAL 2015-02-18 CN claimed
CN-103450078-A 2-aryl-6-(2-aryl acetylenyl) cinolineand and preparation method thereof UNIV LUOYANG NORMAL 2013-12-18 CN claimed
CN-103435542-A 2-biaryl-6-arylquinazoline and preparation method thereof UNIV LUOYANG NORMAL 2013-12-11 CN claimed
CN-102993022-A Preparation method of bromoaniline UNIV SHANGHAI ENG SCIENCE 2013-03-27 CN claimed
US-8354444-B2 Substituted pyrrolidine-2-carboxamides HOFFMANN-LA ROCHE INC. (US) 2013-01-15 US claimed
US-20100152190-A1 Substituted Pyrrolidine-2-Carboxamides F. HOFFMANN-LA ROCHE AG (CH) 2010-06-17 US claimed
US-20100075948-A1 Substituted Pyrrolidine-2-Carboxamides DING QINGJIE 2010-03-25 US claimed
CN-122036750-A Imidazo [1,2-a ] pyrazine derivative and preparation method and application thereof 河北科技大学 2026-05-15 CN disclosed
US-20260108527-A1 POLO LIKE KINASE 4 INHIBITORS ORIC PHARMACEUTICALS INC (US) 2026-04-23 US disclosed
EP-4725554-A2 COMPOUNDS AND COMPOSITIONS FOR MODULATING EGFR MUTANT KINASE ACTIVITIES Yuhan Corporation (KR) 2026-04-15 EP disclosed
US-4169705-A Coloration process IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1979-10-02 US disclosed
US-4160643-A FOR POLYMERS OF ACRYLONITRILE IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1979-07-10 US disclosed
US-4153413-A DYEING POLYESTER OR CELLULOSE TRIACETATE WITH A DISPERSE AZO DYESTUFF, HEAT TREATMENT, PADDING, PRINTING IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1979-05-08 US disclosed
US-4134723-A DYEING AROMATIC POLYESTER/POLYAMIDE OR AROMATIC POLYESTER/CELLULOSE BLENDS WITH DISPERSE MONOAZO DYE, ALKALINE BATH IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1979-01-16 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-20260108527-A1 POLO LIKE KINASE 4 INHIBITORS PLK4, PLK2, PLK3 ALDH1A1 2205/4885CYP3A4 1074/4885TDP1 1427/4885
US-20100152190-A1 Substituted Pyrrolidine-2-Carboxamides ARG2, CCNY, PYCR1 ALDH1A1 2027/4885CYP3A4 740/4885TDP1 1575/4885
US-20100075948-A1 Substituted Pyrrolidine-2-Carboxamides ARG2, CCNY, PYCR1 ALDH1A1 2027/4885CYP3A4 740/4885TDP1 1575/4885

“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.