SCHEMBL8022804

SCHEMBL8022804

FC(F)(F)c1cccc2[nH]nnc12

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AXL P30530 1/20 0.49
KIF11 P52732 2/20 0.41
PARP1 P09874 2/20 0.40
GRM2 Q14416 1/20 0.39
HSD11B1 P28845 3/20 0.37
TRPA1 O75762 3/20 0.36
NOTUM Q6P988 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GRM4 Q14833 2/20 0.34
NCF1 P14598 1/20 0.34

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
SCHEMBL702107 0.86 KIF11 (0.42) AXLKIF11TRPA1ALDH1A1TDP1
SCHEMBL6905689 0.81 AXL (0.33) AXLKIF11
SCHEMBL28473114 0.79 KIF11 (0.33) AXLKIF11
SCHEMBL15519432 0.78
SCHEMBL28994959 0.78 KIF11 (0.33) KIF11
SCHEMBL30027744 0.78 KIF11 (0.36) KIF11TRPA1ALDH1A1GRM4
SCHEMBL31668752 0.77 KIF11 (0.31) AXLKIF11
SCHEMBL28360108 0.75 TRPA1 (0.42) AXLKIF11HSD11B1TRPA1TRPM8
SCHEMBL17150367 0.75 PARP1 (0.58) AXLKIF11PARP1NOTUML3MBTL1
SCHEMBL28320385 0.75 KIF11 (0.31) KIF11

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115667580-A Conductive particle, conductive material using same, and connection structure 日本化学工业株式会社 2023-01-31 CN disclosed
CN-115667579-A Method for producing conductive particles and conductive particles 日本化学工业株式会社 2023-01-31 CN disclosed
CN-112384994-B Coated particles 日本化学工业株式会社 2022-10-04 CN disclosed
CN-113270631-A Electrolyte for high energy density graphite-containing batteries 通用汽车环球科技运作有限责任公司 2021-08-17 CN disclosed
US-10947263-B2 Cyclic dinucleotides as anticancer agents BRISTOL-MYERS SQUIBB COMPANY (US) 2021-03-16 US disclosed
US-20200223883-A1 CYCLIC DINUCLEOTIDES AS ANTICANCER AGENTS BRISTOL MYERS SQUIBB CO (US) 2020-07-16 US disclosed
WO-2019046498-A1 CYCLIC DINUCLEOTIDES AS ANTICANCER AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2019-03-07 WO disclosed
EP-2941419-A1 UV-ABSORBERS FOR OPHTHALMIC LENS MATERIALS Novartis AG (CH) 2015-11-11 EP disclosed
WO-2015072991-A1 UV-ABSORBERS FOR OPHTHALMIC LENS MATERIALS NOVARTIS AG (CH) 2015-05-21 WO disclosed
US-8585938-B1 UV-absorbers for ophthalmic lens materials NOVARTIS AG (CH) 2013-11-19 US disclosed
EP-0971049-A1 Methods of inhibiting corrosion using halo-benzotriazoles BetzDearborn Inc (US) 2000-01-12 EP disclosed
US-5863463-A Methods of inhibiting corrosion using halo-benzotriazoles BETZDEARBORN INC. (US) 1999-01-26 US disclosed
US-5863464-A ADDING TO AN AQUEOUS SYSTEM TREATED WITH HALOGEN AN EFFECTIVE AMOUNT OF MONO OR DI-HALOBENZOTRIAZOLE CORROSION INHIBITOR OR ANTIDEPOSIT AGENT BETZDEARBORN INC. (US) 1999-01-26 US disclosed
US-5772919-A CORROSION RESISTANCE OF METALS IN AQUEOUS SYSTEMS AND WITH HALOGEN TREATMENT BETZDEARBORN INC. (US) 1998-06-30 US disclosed
US-5773627-A MIXING SODIUM HYPOHALITE WITH AQUEOUS SLURRY OR SUSPENSION OF A BENZOTRIAZOLE BETZDEARBORN INC. (US) 1998-06-30 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 (2 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-10947263-B2 Cyclic dinucleotides as anticancer agents DPYD, NTPCR, CD38 AXL 4481/4885KIF11 3568/4885PARP1 21/4885
US-20200223883-A1 CYCLIC DINUCLEOTIDES AS ANTICANCER AGENTS DPYD, NTPCR, CD38 AXL 4481/4885KIF11 3568/4885PARP1 21/4885

“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.