SCHEMBL23398793

SCHEMBL23398793

Cn1nc(-c2ccccc2)c(O)c1C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.43
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP1 P29466 1/20 0.41
BRCA1 P38398 1/20 0.41
HTT P42858 1/20 0.41
CASP7 P55210 1/20 0.41
KMT2A Q03164 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
HSD17B10 Q99714 1/20 0.41
POLB P06746 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CSF1R P07333 1/20 0.40
FGFR1 P11362 1/20 0.40
FLT1 P17948 1/20 0.40
KDR P35968 1/20 0.40
CSNK1A1 P48729 1/20 0.40
CDK8 P49336 1/20 0.40

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
SCHEMBL23399817 0.85 SMN1; SMN2 (0.37) MEN1MAPTMAPK1HTTKMT2A
SCHEMBL23399361 0.81 SRC (0.44) MAPTHTTKMT2ASMN1; SMN2KDM4E
SCHEMBL24417664 0.81 MEN1 (0.42) RECQLMEN1MAPTMAPK1CASP1
SCHEMBL12859402 0.81 MAPT (0.42) RECQLMEN1MAPTMAPK1CASP1
SCHEMBL23400153 0.80 MEN1 (0.48) MEN1MAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL23398407 0.80 MEN1 (0.48) RECQLMEN1MAPTMAPK1CASP1
SCHEMBL23399033 0.79 ESR1 (0.42) RECQLMAPTKMT2AKDRKDM4E
SCHEMBL23400580 0.79 KMT2A (0.46) MEN1MAPTMAPK1CASP1HTT
SCHEMBL11674731 0.78 MEN1 (0.50) RECQLMEN1MAPTMAPK1CASP1
SCHEMBL23402462 0.77 RECQL (0.46) RECQLMEN1MAPTMAPK1CASP1

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-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed