SCHEMBL1265098

SCHEMBL1265098

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

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 1/20 0.64
TSHR P16473 2/20 0.58
LMNA P02545 1/20 0.58
HCAR3 P49019 12/20 0.54
APEX1 P27695 1/20 0.50
POLB P06746 1/20 0.49

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
SCHEMBL29886656 1.00 CASP6 (0.64) CASP6TSHRLMNAHCAR3APEX1
SCHEMBL615414 0.87 CASP6 (0.64) CASP6TSHRLMNAHCAR3APEX1
SCHEMBL5262777 0.85 KMT2A (0.55) CASP6TSHRLMNAHCAR3POLB
SCHEMBL29886670 0.85 ALDH1A1 (0.47) CASP6TSHRLMNAPOLB
SCHEMBL1727109 0.85 PARP1 (0.59) TSHRLMNAPOLB
SCHEMBL3094851 0.85 ALDH1A1 (0.47) CASP6TSHRLMNAPOLB
SCHEMBL3855174 0.83 CASP6 (0.64) CASP6TSHRLMNAHCAR3APEX1
SCHEMBL27967430 0.83 HDAC6 (0.54) CASP6TSHRLMNAPOLB
SCHEMBL10219768 0.82 CASP6 (0.49) CASP6TSHRLMNAHCAR3APEX1
SCHEMBL13529954 0.81 NOTUM (0.60) TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119220056-B Composite material based on fluorine-containing resin and preparation method thereof 江西朝晖氟塑制品有限公司 2025-03-11 CN claimed
CN-119220056-A Composite material based on fluorine-containing resin and preparation method thereof 江西朝晖氟塑制品有限公司 2024-12-31 CN claimed
CN-108558672-B Preparation method of 2-nitro-4-trifluoromethylbenzoic acid and isomer thereof 利尔化学股份有限公司 2021-04-30 CN claimed
CN-108558672-A The preparation method of 2- nitro -4- trifluoromethylbenzoic acids and its isomers 利尔化学股份有限公司 2018-09-21 CN claimed
US-7732625-B2 Colorant compounds XEROX CORPORATION (US) 2010-06-08 US claimed
US-7311767-B2 Forming a salt of a liquid phase change ink carrier of stearyl stearamide, an amine substituted Xanthene, acridine, anthracene or thioxanthene chromogen, and a metal salt capable of forming a compound with two chromogens XEROX CORPORATION (US) 2007-12-25 US claimed
US-7033424-B2 Phase change inks XEROX CORPORATION (US) 2006-04-25 US claimed
US-20060021546-A1 Processes for preparing phase change inks XEROX CORPORATION 2006-02-02 US claimed
US-20060020141-A1 Metallized dye XEROX CORPORATION 2006-01-26 US claimed
US-20060016369-A1 PHASE CHANGE INKS XEROX CORPORATION 2006-01-26 US claimed
US-4845279-A Method of preparing 4-trifluoromethyl-2-nitrobenzoic acid and novel isomer CENTRAL GLASS COMPANY, LIMITED (JP) 1989-07-04 US claimed
JP-1221356-A None JP disclosed
CN-119220056-B Composite material based on fluorine-containing resin and preparation method thereof 江西朝晖氟塑制品有限公司 2025-03-11 CN disclosed
CN-119220056-A Composite material based on fluorine-containing resin and preparation method thereof 江西朝晖氟塑制品有限公司 2024-12-31 CN disclosed
WO-2022138791-A1 EP2 ANTAGONIST 小野薬品工業株式会社 2022-06-30 WO disclosed
JP-H01221356-A 3-AMINO-4-TRIFLUOROMETHYLBENZOIC ACID AND ITS PRODUCTION CENTRAL GLASS CO LTD 1989-09-04 JP disclosed
US-4845279-A Method of preparing 4-trifluoromethyl-2-nitrobenzoic acid and novel isomer CENTRAL GLASS COMPANY, LIMITED (JP) 1989-07-04 US disclosed
US-4845279-A Method of preparing 4-trifluoromethyl-2-nitrobenzoic acid and novel isomer CENTRAL GLASS COMPANY, LIMITED (JP) 1989-07-04 US disclosed
EP-0301692-A2 4,7-Benzofurandione derivatives MERCK FROSST CANADA INC. (CA) 1989-02-01 EP disclosed
EP-0295851-A1 4,7-diacyloxybenzofuran derivatives MERCK FROSST CANADA INC. (CA) 1988-12-21 EP 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 (1 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-20060020141-A1 Metallized dye CDYL, CDY1; CDY1B, CDYL2 CASP6 2660/4885TSHR 2894/4885LMNA 1769/4885

“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.