SCHEMBL23403003

SCHEMBL23403003

CCc1c(-c2ccccc2C)[nH]n(C(C)C)c1=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
HSD17B10 Q99714 1/20 0.42
KDM5A P29375 1/20 0.38
BRD4 O60885 1/20 0.35
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33
TP53 P04637 1/20 0.33
RECQL P46063 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
SCHEMBL23398680 0.89 CYBB (0.38) KDM4EHSD17B10KDM5ABRD4ALDH1A1
SCHEMBL23401028 0.88 NPC1 (0.38) KDM4EHSD17B10BRD4ALDH1A1HPGD
SCHEMBL23401270 0.87 MAPT (0.35) KDM4EHSD17B10KDM5ABRD4ALDH1A1
SCHEMBL23401401 0.82 RAB9A (0.40) KDM4EHSD17B10BRD4ALDH1A1HPGD
SCHEMBL23398478 0.81 KDM4E (0.45) KDM4EHSD17B10KDM5ABRD4ALDH1A1
SCHEMBL23403549 0.81 CYBB (0.42) KDM4EHSD17B10KDM5AALDH1A1HPGD
SCHEMBL23399949 0.81 ALDH1A1 (0.48) KDM4EHSD17B10KDM5ABRD4ALDH1A1
SCHEMBL23401162 0.79 KDM4E (0.44) KDM4EHSD17B10KDM5ABRD4ALDH1A1
SCHEMBL23402977 0.77 GAA (0.40) KDM4EHSD17B10BRD4HPGDNPC1
SCHEMBL23399813 0.77 MAPT (0.43) KDM4EHSD17B10KDM5ABRD4ALDH1A1

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