SCHEMBL23398985

SCHEMBL23398985

CCc1c(O)c(-c2ccccc2)nn1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
NR4A3 Q92570 1/20 0.44
MAPT P10636 1/20 0.44
FABP3 P05413 3/20 0.43
FABP4 P15090 3/20 0.43
ALDH1A1 P00352 3/20 0.42
EGFR P00533 1/20 0.42
SRC P12931 1/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
ATM Q13315 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PTGS2 P35354 3/20 0.42
PTGS1 P23219 2/20 0.42
FABP5 Q01469 2/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL23402133 0.91 KMT2A (0.47) MEN1KMT2ANR4A3MAPTALDH1A1
SCHEMBL23402489 0.91 MEN1 (0.43) MEN1KMT2AMAPTFABP3FABP4
SCHEMBL23400347 0.88 KMT2A (0.49) MEN1KMT2AMAPTALDH1A1EGFR
SCHEMBL23403249 0.87 RPA1 (0.48) MEN1KMT2AMAPTFABP3FABP4
SCHEMBL23401183 0.87 RPA1 (0.47) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL23403103 0.85 CNR1 (0.47) MEN1KMT2AMAPTALDH1A1EGFR
SCHEMBL20054832 0.83 FABP4 (0.53) MEN1KMT2ANR4A3MAPTFABP3
SCHEMBL23402469 0.83 MEN1 (0.44) MEN1KMT2AMAPTALDH1A1EGFR
SCHEMBL23402827 0.83 KMT2A (0.43) MEN1KMT2AMAPTALDH1A1SRC
SCHEMBL23398949 0.80 RECQL (0.47) MEN1KMT2AMAPTFABP3FABP4

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