SCHEMBL23399313

SCHEMBL23399313

CCc1c(-c2ccccc2C)nn(-c2ccccc2)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
USP2 O75604 1/20 0.42
DCTPP1 Q9H773 1/20 0.39
MAPT P10636 1/20 0.39
KDM4A O75164 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
FABP3 P05413 1/20 0.37
NT5E P21589 1/20 0.36
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
P2RX7 Q99572 1/20 0.36
KDM5A P29375 1/20 0.36

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
SCHEMBL23399037 0.92 DCTPP1 (0.41) LMNATSHRUSP2DCTPP1MAPT
SCHEMBL23402986 0.89 USP2 (0.49) LMNATSHRUSP2DCTPP1MAPT
SCHEMBL23403473 0.88 RPA1 (0.41) LMNATSHRUSP2MAPTNPC1
SCHEMBL23402226 0.88 USP2 (0.45) LMNATSHRUSP2DCTPP1MAPT
SCHEMBL23402327 0.87 CA1 (0.41) LMNATSHRMAPTNPC1RAB9A
SCHEMBL23403396 0.86 TP53 (0.36) LMNATSHRMAPTKDM4EALDH1A1
SCHEMBL23400890 0.85 TSHR (0.39) LMNATSHRUSP2DCTPP1MAPT
SCHEMBL23400820 0.82 KMT2A (0.48) LMNATSHRUSP2MAPTNPC1
SCHEMBL23400873 0.82 DCTPP1 (0.43) LMNATSHRUSP2DCTPP1MAPT
SCHEMBL23402397 0.81 KDM5A (0.38) LMNATSHRUSP2MAPTRAB9A

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