SCHEMBL706407

SCHEMBL706407

COc1ccc(C(F)(F)F)cn1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
HPGD P15428 1/20 0.53
LMNA P02545 1/20 0.53
KMT2A Q03164 2/20 0.51
MAPK1 P28482 1/20 0.50
DYRK3 O43781 1/20 0.49
CCNA2 P20248 1/20 0.49
CDK2 P24941 1/20 0.49
DYRK1A Q13627 1/20 0.49
DYRK2 Q92630 1/20 0.49
DYRK1B Q9Y463 1/20 0.49
MAPT P10636 3/20 0.48
NPC1 O15118 1/20 0.48
THRB P10828 1/20 0.47
LIPE Q05469 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
KDR P35968 1/20 0.46
TEK Q02763 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
SCHEMBL30980818 1.00 TSHR (0.63) TSHRSMN1; SMN2HPGDLMNAKMT2A
SCHEMBL5645688 0.88 LMNA (0.62) TSHRSMN1; SMN2HPGDLMNAKMT2A
SCHEMBL17531157 0.86 TSHR (0.49) TSHRSMN1; SMN2HPGDLMNAKMT2A
SCHEMBL22302827 0.82 TSHR (0.46) TSHRSMN1; SMN2HPGDLMNAKMT2A
SCHEMBL10387449 0.82 LMNA (0.68) TSHRSMN1; SMN2HPGDLMNAKMT2A
SCHEMBL25184403 0.82 TSHR (0.47) TSHRSMN1; SMN2LMNADYRK3CCNA2
SCHEMBL1515571 0.82 NNMT (0.46) TSHRSMN1; SMN2HPGDLMNADYRK3
SCHEMBL23188126 0.81 TSHR (0.45) TSHRSMN1; SMN2HPGDLMNAKMT2A
SCHEMBL23188080 0.81 TSHR (0.45) TSHRSMN1; SMN2HPGDLMNAKMT2A
SCHEMBL20381745 0.81 HPGD (0.51) TSHRSMN1; SMN2HPGDLMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115850082-B Preparation method of 2-nitro-4-trifluoromethyl benzoic acid 内蒙古蓝科生物科技有限公司 2025-05-06 CN disclosed
US-20250049966-A1 SMALL MOLECULE TRACER FOR IMAGING ALPHA-SYNUCLEIN AGGREGATES FUDAN UNIVERSITY (CN) 2025-02-13 US disclosed
US-20240390340-A1 PYRROLIDINE KRAS INHIBITORS INCYTE CORP (US) 2024-11-28 US disclosed
US-20240246964-A1 SUBSTITUTED 1-ARYL-1’-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1’-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2024-07-25 US disclosed
US-11998538-B2 Piperidine urea derivatives as soluble epoxide hydrolase inhibitors NEUROPN THERAPEUTICS (US) 2024-06-04 US disclosed
US-20240024313-A1 BIARYL ETHER UREA COMPOUNDS Jazz Pharmaceuticals Therapeutics, Inc. 2024-01-25 US disclosed
WO-2023239629-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THAT DEGRADE CDK2 Plexium, Inc. (US) 2023-12-14 WO disclosed
EP-3730494-B1 HETEROCYCLIC COMPOUND AND HARMFUL ARTHROPOD CONTROLLING AGENT CONTAINING SAME SUMITOMO CHEMICAL CO (JP) 2023-11-08 EP disclosed
US-20230232827-A1 METHOD FOR CONTROLLING SOYBEAN RUST FUNGUS RESISTANT TO QoI FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-07-27 US disclosed
WO-2023109745-A1 SMALL-MOLECULE PROBE FOR IMAGING OF α-SYNUCLEIN AGGREGATE 复旦大学 2023-06-22 WO disclosed
EP-1592426-B1 2-CYANOPYRROLOPYRIMIDINES AND PHARMACEUTICAL USES THEREOF NOVARTIS AG (CH) 2007-12-19 EP disclosed
CN-1918165-A Azabicyclic heterocycles as cannabinoid receptor modulators BRISTOL MYERS SQUIBB CO (US) 2007-02-21 CN disclosed
US-7160877-B2 Aliphatic nitrogen-containing 5-membered ring compound TANABE SEIYAKU CO., LTD. (JP) 2007-01-09 US disclosed
US-7160877-B2 Aliphatic nitrogen-containing 5-membered ring compound TANABE SEIYAKU CO., LTD. (JP) 2007-01-09 US disclosed
CN-1882545-A Substituted nicotinoylcarbamates as pesticides BAYER CROPSCIENCE AG (DE) 2006-12-20 CN disclosed
WO-2004069256-A1 2-CYANOPYRROLOPYRIMIDINES AND PHARMACEUTICAL USES THEREOF NOVARTIS AG (CH) 2004-08-19 WO disclosed
US-6225320-B1 TREATMENT OF PAIN, INFLAMMATION, MIGRAINE, EMESIS AND POSTTHERPETIC NEURALGIA MERCK SHARP & DOHME LTD. (GB) 2001-05-01 US disclosed
EP-0989987-A1 SPIRO-AZACYCLIC DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LTD. (GB) 2000-04-05 EP disclosed
EP-0953566-A2 Selective transformation of pyridines with electrophiles BASF AKTIENGESELLSCHAFT (DE) 1999-11-03 EP disclosed
WO-1998054187-A1 SPIRO-AZACYCLIC DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LIMITED (GB) 1998-12-03 WO 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-20240024313-A1 BIARYL ETHER UREA COMPOUNDS FAAH, FAAH2, FAH TSHR 2607/4885SMN1; SMN2 2993/4885HPGD 969/4885
US-20240390340-A1 PYRROLIDINE KRAS INHIBITORS KRAS, NRAS, HRAS TSHR 4532/4885SMN1; SMN2 3615/4885HPGD 448/4885
US-20240246964-A1 SUBSTITUTED 1-ARYL-1’-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1’-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME HAVCR2, HDGF, HCCS TSHR 2392/4885SMN1; SMN2 4097/4885HPGD 836/4885
US-11998538-B2 Piperidine urea derivatives as soluble epoxide hydrolase inhibitors EPHX1, EPHX2, HPGDS TSHR 4531/4885SMN1; SMN2 3266/4885HPGD 43/4885
US-20250049966-A1 SMALL MOLECULE TRACER FOR IMAGING ALPHA-SYNUCLEIN AGGREGATES SNCA, PARK7, GDI1 TSHR 3073/4885SMN1; SMN2 873/4885HPGD 4322/4885
US-20230232827-A1 METHOD FOR CONTROLLING SOYBEAN RUST FUNGUS RESISTANT TO QoI FUNGICIDES CYC1, SQOR, MT-CO3 TSHR 3023/4885SMN1; SMN2 4452/4885HPGD 3144/4885

“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.