SCHEMBL23401765

SCHEMBL23401765

CCCc1nn(-c2ccccc2)c(O)c1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.49
ALDH1A1 P00352 3/20 0.42
MAPK1 P28482 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 2/20 0.41
TSHR P16473 1/20 0.41
GAA P10253 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
KDM4C Q9H3R0 1/20 0.39
PDE4D Q08499 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL23399973 0.91 USP2 (0.44) USP2ALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL23401429 0.87 TP53 (0.38) USP2ALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL23402131 0.87 ALDH1A1 (0.51) USP2ALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL23401449 0.85 USP2 (0.47) USP2ALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL23398595 0.85 ALDH1A1 (0.43) USP2ALDH1A1L3MBTL1LMNAGAA
SCHEMBL23401063 0.84 USP2 (0.47) USP2ALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL23402506 0.83 USP2 (0.45) USP2ALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL23400228 0.81 USP2 (0.44) USP2ALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL23401205 0.81 KDM4C (0.53) USP2ALDH1A1MAPK1L3MBTL1LMNA
SCHEMBL23403047 0.81 ALDH1A1 (0.49) USP2ALDH1A1MAPK1L3MBTL1LMNA

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