SCHEMBL23937805

SCHEMBL23937805

CCn1cc(C)c2sccc21

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.35
GAA P10253 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.31
KDM1A O60341 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE7A Q13946 1/20 0.31
TNFRSF1A P19438 1/20 0.30

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
SCHEMBL20673887 0.78 KMT2A (0.33) KMT2APDE7A
SCHEMBL20674234 0.75 KMT2A (0.32) KMT2A
SCHEMBL23937801 0.74 KMT2A (0.33) KMT2APDE4BPDE7A
SCHEMBL23937800 0.74 NR4A2 (0.40) KMT2AGAA
SCHEMBL20673904 0.73 MAP2K2 (0.41) KMT2A
SCHEMBL20631042 0.72 GAA (0.32) GAAPTGDR2
SCHEMBL20674231 0.71 LMNA (0.43) KMT2AKDM1A
SCHEMBL20673902 0.67
SCHEMBL14985269 0.64 KDM1A (0.34) KMT2AGAAKDM1A
SCHEMBL665932 0.64 MEN1 (0.56) 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
EP-3399968-B1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE CS PHARMATECH LTD (KY) 2021-10-20 EP disclosed