SCHEMBL17020106

SCHEMBL17020106

Cc1ncn(CC(F)(F)F)c1N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 4/20 0.37
CYP1A2 P05177 1/20 0.37
FDPS P14324 1/20 0.37
PI4KA P42356 2/20 0.33
PI4K2B Q8TCG2 2/20 0.33
PI4K2A Q9BTU6 2/20 0.33
PI4KB Q9UBF8 2/20 0.33
ADORA2A P29274 2/20 0.33
ADORA1 P30542 1/20 0.33
CDK1 P06493 1/20 0.32
CCNB1 P14635 1/20 0.32
CCNE1 P24864 1/20 0.32
CDK2 P24941 1/20 0.32
TLR7 Q9NYK1 1/20 0.30
CSNK1E P49674 1/20 0.30
CLK1 P49759 1/20 0.30
CLK2 P49760 1/20 0.30
CLK3 P49761 1/20 0.30
CDK9 P50750 1/20 0.30
CDK5 Q00535 1/20 0.30

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
SCHEMBL18256662 0.80 FDPS (0.54) CYP17A1CYP1A2FDPS
SCHEMBL17008880 0.73 TGFBR1 (0.37) FDPSPI4KAPI4K2BPI4K2API4KB
SCHEMBL17020121 0.73 FDPS (0.37) CYP17A1CYP1A2FDPS
SCHEMBL3190866 0.72 KDM4E (0.42) CYP1A2ADORA2AADORA1
SCHEMBL17008881 0.70 ALDH1A1 (0.38) CYP17A1CYP1A2FDPS
SCHEMBL17008902 0.69 CSNK2A1 (0.42) CYP17A1FDPSADORA2A
SCHEMBL32683372 0.68 CYP17A1 (0.38) CYP17A1CYP1A2
SCHEMBL17008875 0.68 MAPK14 (0.41) PI4KAPI4KB
SCHEMBL17008872 0.68 MEN1 (0.50) CYP1A2FDPSADORA2ADYRK1A
SCHEMBL6123472 0.65 CYP17A1 (0.42) CYP17A1CYP1A2FDPSTLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106170478-B GPR142 agonist compound 伊莱利利公司 2019-04-09 CN disclosed
EP-3105207-B1 GPR142 AGONIST COMPOUNDS LILLY CO ELI (US) 2018-08-22 EP disclosed
US-9861613-B2 GPR142 agonist compounds ELI LILLY AND COMPANY (US) 2018-01-09 US disclosed
US-9861613-B2 GPR142 agonist compounds ELI LILLY AND COMPANY (US) 2018-01-09 US disclosed
US-20170165234-A1 GPR142 Agonist Compounds ELI LILLY AND COMPANY 2017-06-15 US disclosed
US-20170165234-A1 GPR142 Agonist Compounds ELI LILLY AND COMPANY 2017-06-15 US disclosed
US-20170165234-A1 GPR142 Agonist Compounds ELI LILLY AND COMPANY 2017-06-15 US disclosed
CN-106170478-A GPR142 agonist compound 伊莱利利公司 2016-11-30 CN disclosed
WO-2015120768-A1 GPR142 AGONIST COMPOUNDS ELI LILLY AND COMPANY (US) 2015-08-20 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 (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-20170165234-A1 GPR142 Agonist Compounds GPR3, GPR142, GPR27 CYP17A1 1245/4885CYP1A2 1878/4885FDPS 3544/4885

“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.