SCHEMBL23345977

SCHEMBL23345977

CNc1ccc(-n2ccc(=O)[nH]c2=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 5/20 0.59
DDB1 Q16531 1/20 0.59
PKM P14618 2/20 0.35
HCAR1 Q9BXC0 1/20 0.34
ATM Q13315 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
CA9 Q16790 1/20 0.33
DUT P33316 1/20 0.33

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
SCHEMBL5325743 0.79 CRBN (0.66) CRBNDDB1PKMHCAR1
SCHEMBL21995599 0.76 CRBN (0.66) CRBNDDB1PKMHCAR1KMT2A
SCHEMBL25207533 0.76 CRBN (0.66) CRBNDDB1PKMMEN1KMT2A
SCHEMBL23120610 0.76 CRBN (0.66) CRBNDDB1PKMHCAR1KMT2A
SCHEMBL26096140 0.76 CRBN (0.66) CRBNDDB1HCAR1CA1CA2
SCHEMBL28744560 0.75 CRBN (0.59) CRBNDDB1PKMHCAR1ATM
SCHEMBL5289086 0.75 CRBN (0.59) CRBNDDB1PKMHCAR1ATM
SCHEMBL25565834 0.75 CRBN (0.59) CRBNDDB1PKMMEN1KMT2A
SCHEMBL1530734 0.75 CRBN (1.00) CRBNDDB1HCAR1ATMDUT
SCHEMBL23345942 0.75 PKM (0.43) PKMMEN1KMT2A

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-3819006-A1 COMPOUNDS WITH THYMINE SKELETON FOR USE IN MEDICINE Technische Universität Dresden (DE) 2021-05-12 EP disclosed