SCHEMBL23398392

SCHEMBL23398392

CCCc1c(C)c(O)nn1-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.49
LMNA P02545 3/20 0.41
POLB P06746 2/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 4/20 0.41
RAB9A P51151 3/20 0.41
MAPT P10636 2/20 0.41
MAPK1 P28482 2/20 0.41
GAA P10253 1/20 0.41
PKM P14618 1/20 0.39
NPC1 O15118 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
MAPK14 Q16539 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 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
SCHEMBL23402716 0.91 USP2 (0.44) USP2LMNAPOLBTSHRRAB9A
SCHEMBL23401740 0.87 USP2 (0.46) USP2LMNAPOLBTSHRALDH1A1
SCHEMBL23398395 0.87 TP53 (0.38) USP2LMNATSHRALDH1A1RAB9A
SCHEMBL23399595 0.87 LMNA (0.47) USP2LMNAPOLBTSHRALDH1A1
SCHEMBL23401225 0.86 USP2 (0.46) USP2LMNAPOLBTSHRALDH1A1
SCHEMBL23399754 0.86 USP2 (0.45) USP2LMNAPOLBTSHRALDH1A1
SCHEMBL23401733 0.85 ALDH1A1 (0.43) USP2LMNAALDH1A1RAB9AMAPT
SCHEMBL23403617 0.82 PDE4D (0.44) LMNAALDH1A1MAPTPDE4DMEN1
SCHEMBL23403013 0.81 USP2 (0.44) USP2LMNAPOLBTSHRRAB9A
SCHEMBL23402622 0.81 USP2 (0.49) USP2LMNAPOLBTSHRALDH1A1

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