SCHEMBL1104675

SCHEMBL1104675

CC(C)(C)c1ccc(Cl)c([N+](=O)[O-])c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 13/20 0.51
ALDH1A1 P00352 4/20 0.49
NPC1 O15118 1/20 0.49
GLA P06280 1/20 0.49
MAPK1 P28482 1/20 0.49
CASP3 P42574 1/20 0.49
HTT P42858 1/20 0.49
RAB9A P51151 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
HPGD P15428 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
HIF1A Q16665 1/20 0.46
TXNRD1 Q16881 1/20 0.46
TXNRD3 Q86VQ6 1/20 0.46
TXNRD2 Q9NNW7 1/20 0.46

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
SCHEMBL10602703 0.89 GPR35 (0.55) VCAM1ALDH1A1MAPK1HPGDTDP1
SCHEMBL12591651 0.86 VCAM1 (0.53) VCAM1ALDH1A1MAPK1HPGDTSHR
SCHEMBL10907199 0.83 VCAM1 (0.53) VCAM1ALDH1A1MAPK1HPGDTDP1
SCHEMBL6222813 0.82 TSHR (0.55) ALDH1A1NPC1GLAMAPK1CASP3
SCHEMBL6821981 0.82 VCAM1 (0.53) VCAM1ALDH1A1NPC1GLAMAPK1
SCHEMBL140068 0.81 ALDH1A1 (0.65) VCAM1ALDH1A1MAPK1HPGDTDP1
SCHEMBL7218755 0.81 TDP1 (0.55) VCAM1ALDH1A1MAPK1HPGDTDP1
SCHEMBL4089390 0.79 NPC1 (0.60) ALDH1A1NPC1GLAMAPK1CASP3
SCHEMBL13945797 0.79 ALDH1A1 (0.50) ALDH1A1NPC1GLAMAPK1CASP3
SCHEMBL29588338 0.79 NPC1 (0.60) ALDH1A1NPC1GLAMAPK1CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12391663-B2 Isoindolinone compounds MONTE ROSA THERAPEUTICS AG (CH) 2025-08-19 US disclosed
US-20240261274-A1 TREATMENT OF MYC-DRIVEN CANCERS WITH GSPT1 DEGRADERS MONTE ROSA THERAPEUTICS AG (CH) 2024-08-08 US disclosed
CN-117924041-A Method for preparing high-purity m-tertiary butyl phenol by layered melt crystallization 天津科技大学 2024-04-26 CN disclosed
CN-117886674-A Synthesis method of m-tert-butylphenol 蔚源生物科技(平顶山)有限公司 2024-04-16 CN disclosed
US-20240083869-A1 ISOINDOLINONE COMPOUNDS MONTE ROSA THERAPEUTICS AG (CH) 2024-03-14 US disclosed
US-11912682-B2 Isoindolinone compounds MONTE ROSA THERAPEUTICS, INC. (US) 2024-02-27 US disclosed
CN-117242060-A Isoindolinone compounds 蒙特罗萨医疗公司 2023-12-15 CN disclosed
US-20230348418-A1 ISOINDOLINONE COMPOUNDS MONTE ROSA THERAPEUTICS AG (CH) 2023-11-02 US disclosed
US-20230288804-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-09-14 US disclosed
CN-108383689-B A kind of preparation method of 3,5- DI-tert-butylphenol compounds 江苏极易新材料有限公司 2019-03-26 CN disclosed
US-7189501-B2 Silver halide color photographic photosensitive material FUJI PHOTO FILM CO., LTD. (JP) 2007-03-13 US disclosed
US-20070037794-A1 4-((5-Chloro-3-(4-methyl-3-trifluoromethylbenzenesulfonylamino)pyridin-2-yl)-oxo-)1H-pyrrolo(2,3-)pyridine;interfere with ligand (monocyte chemoatactic protein-1) for chemokine receptors (CCR2); antiinflammatory agents; immunomodulators; bactericides; viricides; fungicides CHEMOCENTRYX, INC. 2007-02-15 US disclosed
US-7125988-B2 Dye-forming coupler and silver halide color photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 2006-10-24 US disclosed
US-6887657-B2 Silver halide color photographic photosensitive material and image-forming method FUJI PHOTO FILM CO., LTD. (JP) 2005-05-03 US disclosed
US-20050074710-A1 Silver halide color photographic photosensitive material FUJI PHOTO FILM CO., LTD. 2005-04-07 US disclosed
US-20040234908-A1 Silver halide color photographic photosensitive material and image-forming method FUJI PHOTO FILM CO., LTD. 2004-11-25 US disclosed
EP-1403704-A1 Dye-forming coupler and silver halide color photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 2004-03-31 EP disclosed
US-4133673-A HERBICIDES UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1979-01-09 US disclosed
US-4133672-A (Aminophenyl)morpholines and use thereof UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1979-01-09 US disclosed
US-4094662-A HERBICIDES UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1978-06-13 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-20070037794-A1 4-((5-Chloro-3-(4-methyl-3-trifluoromethylbenzenesulfonylamino)pyridin-2-yl)-oxo-)1H-pyrrolo(2,3-)pyridine;interfere with ligand (monocyte chemoatactic protein-1) for chemokine receptors (CCR2); antiinflammatory agents; immunomodulators; bactericides; viricides; fungicides CCR2, CCR1, CCL2 VCAM1 47/4885ALDH1A1 1867/4885NPC1 3061/4885
US-12391663-B2 Isoindolinone compounds CYP4F2, AOC2, AOC3 VCAM1 4379/4885ALDH1A1 1142/4885NPC1 285/4885
US-20240083869-A1 ISOINDOLINONE COMPOUNDS CYP4F2, AOC2, AOC3 VCAM1 4379/4885ALDH1A1 1142/4885NPC1 285/4885
US-20230348418-A1 ISOINDOLINONE COMPOUNDS CYP4F2, AOC2, AOC3 VCAM1 4452/4885ALDH1A1 1370/4885NPC1 269/4885
US-11912682-B2 Isoindolinone compounds CYP4F2, AOC2, AOC3 VCAM1 4379/4885ALDH1A1 1142/4885NPC1 285/4885
US-20240261274-A1 TREATMENT OF MYC-DRIVEN CANCERS WITH GSPT1 DEGRADERS MYC, MYCBP, GSPT1 VCAM1 3385/4885ALDH1A1 4276/4885NPC1 3437/4885

“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.