SCHEMBL30031992

SCHEMBL30031992

C=CC(=O)N1CCC(F)(F)C(Oc2cc(OC)cc3ncnc(Nc4cc(-c5ccc(F)cc5F)ccc4OC)c23)C1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 19/20 0.43
ERBB2 P04626 7/20 0.41
SRC P12931 1/20 0.39
RIPK2 O43353 1/20 0.39
RET P07949 1/20 0.39
MET P08581 1/20 0.39
EPHB2 P29323 1/20 0.39
TEC P42680 1/20 0.39
EPHB4 P54760 1/20 0.39
EPHA4 P54764 1/20 0.39
BTK Q06187 1/20 0.39
KCNH2 Q12809 1/20 0.39
TNK1 Q13470 1/20 0.39
RIPK3 Q9Y572 1/20 0.39

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
SCHEMBL24714585 1.00 EGFR (0.43) EGFRERBB2SRCRIPK2RET
SCHEMBL24714494 0.92 EGFR (0.43) EGFRERBB2RIPK2RETMET
SCHEMBL30031590 0.92 EGFR (0.43) EGFRERBB2RIPK2RETMET
SCHEMBL24714473 0.90 EGFR (0.39) EGFRERBB2SRC
SCHEMBL30031238 0.88 EGFR (0.56) EGFRERBB2RIPK2RETMET
SCHEMBL24713982 0.88 EGFR (0.56) EGFRERBB2RIPK2RETMET
SCHEMBL30031577 0.86 EGFR (0.41) EGFRERBB2SRC
SCHEMBL24714602 0.86 EGFR (0.41) EGFRERBB2SRC
SCHEMBL26129597 0.77 ERBB2 (0.64) EGFRERBB2
SCHEMBL24715219 0.76 EGFR (0.50) EGFRERBB2RIPK2RETMET

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-20240246940-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF VORONOI INC. (KR) 2024-07-25 US disclosed
WO-2022225238-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF 보로노이 주식회사 2022-10-27 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-20240246940-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF ERBB2, EGFR, ERBB3 EGFR 2/4885ERBB2 1/4885SRC 6/4885

“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.