SCHEMBL5113671

SCHEMBL5113671

Cc1nc(NCc2cccc(C(F)(F)F)c2)c2ccccc2n1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APP P05067 6/20 0.74
CCNE2 O96020 2/20 0.59
CCNE1 P24864 2/20 0.59
CDK2 P24941 2/20 0.59
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
BCHE P06276 1/20 0.52
ACHE P22303 1/20 0.52
MITF O75030 1/20 0.52
LMNA P02545 1/20 0.51
TSHR P16473 1/20 0.51
HTT P42858 1/20 0.51
USP1 O94782 2/20 0.51
WDR48 Q8TAF3 2/20 0.51
RAD52 P43351 1/20 0.50
EGFR P00533 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
SCHEMBL24803252 0.87 APP (0.57) APPCCNE2CCNE1CDK2MEN1
SCHEMBL5107781 0.86 APP (0.71) APPCCNE2CCNE1CDK2MEN1
SCHEMBL4859931 0.85 APP (0.70) APPCCNE2CCNE1CDK2MEN1
SCHEMBL4866870 0.84 APP (0.73) APPCCNE2CCNE1CDK2MEN1
SCHEMBL4864021 0.84 APP (0.73) APPCCNE2CCNE1CDK2MEN1
SCHEMBL4863396 0.84 APP (0.73) APPCCNE2CCNE1CDK2MEN1
SCHEMBL4868511 0.83 APP (0.67) APPCCNE2CCNE1CDK2MEN1
SCHEMBL26069922 0.83 SOS1 (0.63) APPMEN1KMT2AMITFLMNA
SCHEMBL3977315 0.83 RAD52 (0.71) APPMEN1KMT2ABCHEACHE
SCHEMBL25112495 0.82 APP (0.52) APPMITFLMNAEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080207614-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DIABETES AND OBESITY SK CHEMICALS CO., LTD. (KR) 2008-08-28 US claimed
US-20080207614-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DIABETES AND OBESITY SK CHEMICALS CO., LTD. (KR) 2008-08-28 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 (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-20080207614-A1 QUINAZOLINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DIABETES AND OBESITY GPR119, GCKR, GLP1R APP 4386/4885CCNE2 3496/4885CCNE1 3853/4885

“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.