SCHEMBL21099155

SCHEMBL21099155

CCNCc1ccc2nccn2c1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.58
MERTK Q12866 3/20 0.44
NAMPT P43490 11/20 0.44
AXL P30530 2/20 0.43
FLT3 P36888 2/20 0.43
DYRK1A Q13627 1/20 0.42
PAK1 Q13153 1/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
KMT2A Q03164 1/20 0.41
RET P07949 1/20 0.40
DAO P14920 1/20 0.40

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
SCHEMBL17790192 0.83 KEAP1 (0.62) KEAP1MERTKNAMPTAXLFLT3
SCHEMBL24484881 0.81 KEAP1 (0.64) KEAP1MERTKAXLFLT3DYRK1A
SCHEMBL74518 0.81 KEAP1 (0.68) KEAP1MERTKNAMPTAXLFLT3
SCHEMBL17788633 0.81 KEAP1 (0.58) KEAP1MERTKNAMPTDYRK1APAK1
SCHEMBL24529535 0.80 DYRK1A (0.47) KEAP1MERTKAXLFLT3DYRK1A
Ammonia Solution, Strong SCHEMBL28922912 0.80 KEAP1 (0.66) KEAP1MERTKNAMPTAXLFLT3
SCHEMBL19764528 0.79 KEAP1 (0.57) KEAP1MERTKNAMPTDYRK1APAK1
SCHEMBL23127994 0.78 KEAP1 (0.55) KEAP1NAMPTDYRK1APAK1RET
SCHEMBL24529202 0.78 TRIM33 (0.46) KEAP1MERTKNAMPTAXLFLT3
SCHEMBL17196187 0.76 KEAP1 (0.57) KEAP1MERTKNAMPTDYRK1APAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10323018-B2 Quinazoline and quinoline compounds and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2019-06-18 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-10323018-B2 Quinazoline and quinoline compounds and uses thereof NAMPT, NQO2, NNMT KEAP1 129/4885MERTK 1208/4885NAMPT 1/4885

“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.