SCHEMBL29834705

SCHEMBL29834705

Nc1ccc(Oc2ccnc(N3CCC(C(F)(F)F)C3)c2)cc1F

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 2/20 0.43
DPP4 P27487 3/20 0.36
DPP7 Q9UHL4 2/20 0.36
TRPV3 Q8NET8 1/20 0.36
DPP8 Q6V1X1 2/20 0.35
DPP9 Q86TI2 2/20 0.35
LRRK2 Q5S007 2/20 0.34
ACACB O00763 1/20 0.34
ABL1 P00519 2/20 0.34
GPR52 Q9Y2T5 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.33
CYP2D6 P10635 1/20 0.33
KCNH2 Q12809 1/20 0.33
SCN9A Q15858 1/20 0.33
EIF2AK4 Q9P2K8 1/20 0.32
CCNC P24863 1/20 0.32
CDK8 P49336 1/20 0.32

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
SCHEMBL29834698 0.82 ACACB (0.37) LRRK2ACACBSCN10A
SCHEMBL29834832 0.81 MAP4K4 (0.39) MAP4K4LRRK2ACACBSCN10ACCNC
SCHEMBL29834784 0.80 HRH4 (0.39) LRRK2CCNCCDK8
SCHEMBL29834720 0.79 HRH4 (0.41) LRRK2CCNCCDK8
SCHEMBL30729909 0.78 MAP4K4 (0.41) MAP4K4ACACBSCN10AKCNH2CCNC
SCHEMBL27096974 0.78 MAP4K4 (0.41) MAP4K4ACACBSCN10AKCNH2CCNC
SCHEMBL24037401 0.77 MAPK13 (0.47) LRRK2ABL1
SCHEMBL29834771 0.76 LRRK2 (0.43) LRRK2
SCHEMBL29834781 0.76 TYK2 (0.36) ACACBGPR52SCN9A
SCHEMBL27299254 0.75 ACACB (0.39) LRRK2ACACB

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-20240398805-A1 QUINAZOLINE DERIVED COMPOUNDS AS EGFR INHIBITORS AND THEIR USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2024-12-05 US disclosed
WO-2022170043-A1 QUINAZOLINE DERIVED COMPOUNDS AS EGFR INHIBITORS AND THEIR USES THEREOF ACCUTAR BIOTECHNOLOGY, INC. (US) 2022-08-11 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-20240398805-A1 QUINAZOLINE DERIVED COMPOUNDS AS EGFR INHIBITORS AND THEIR USES THEREOF ERBB2, EGFR, ERBB4 MAP4K4 240/4885DPP4 1379/4885DPP7 974/4885

“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.