SCHEMBL30833665

SCHEMBL30833665

Clc1ncc(C2CC2)c(Cl)n1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.31
▸ CSNK1A1 P48729 1/20 0.31
▸ CLK4 Q9HAZ1 1/20 0.31

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
SCHEMBL31254720 0.92 KMT2A (0.40) KMT2A
SCHEMBL31255118 0.92 KMT2A (0.37) KMT2A
SCHEMBL27144120 0.82 — —
SCHEMBL13724450 0.79 CSNK1A1 (0.44) KMT2APDE10ACSNK1A1CLK4
SCHEMBL32665751 0.75 CYP1A2 (0.37) KMT2APDE10A
SCHEMBL22634675 0.75 PKM (0.32) KMT2A
SCHEMBL29397730 0.75 PKM (0.32) KMT2A
SCHEMBL16176252 0.75 ALDH1A1 (0.39) PDE10AKDM4E
SCHEMBL26382368 0.75 JUN (0.35) KMT2A
SCHEMBL1330434 0.74 ACHE (0.33) KMT2A

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
CN-113896744-B Selective EGFR inhibitor 成都先导药物开发股份有限公司 2024-04-16 — — CN disclosed
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