SCHEMBL23401480

SCHEMBL23401480

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

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.35
▸ MAPT P10636 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ HPGD P15428 3/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ FPR1 P21462 1/20 0.34
▸ KDM5A P29375 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.33
▸ POLB P06746 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ DUSP3 P51452 1/20 0.30
▸ PTPN5 P54829 1/20 0.30
▸ PTPN11 Q06124 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ CTDSP1 Q9GZU7 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ KDM5B Q9UGL1 2/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL23403419 0.85 KDM4E (0.40) ALDH1A1GAAHPGDKDM5AKDM4E
SCHEMBL23399171 0.83 NPC1 (0.37) MAPTGAACYP1A2KDM4EMEN1
SCHEMBL23400823 0.82 KDM5A (0.33) KDM5A
SCHEMBL23398960 0.80 KDM4E (0.30) ALDH1A1HPGDKDM4E
SCHEMBL23402668 0.78 — —
SCHEMBL23400841 0.76 — —
SCHEMBL23401759 0.76 KDM4E (0.31) ALDH1A1HPGDKDM4E
SCHEMBL23399893 0.74 ALDH1A1 (0.33) ALDH1A1
SCHEMBL23402092 0.73 ALDH1A1 (0.36) ALDH1A1MAPTGAAHPGDCYP1A2
SCHEMBL23401416 0.72 ALDH1A1 (0.37) ALDH1A1MAPTGAAHPGDCYP1A2

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
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