SCHEMBL23399595

SCHEMBL23399595

CCc1c(C)c(O)nn1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
NR4A3 Q92570 1/20 0.46
POLB P06746 3/20 0.43
USP2 O75604 1/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
PDE4D Q08499 1/20 0.40
KDM4E B2RXH2 3/20 0.40
HSD17B10 Q99714 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
APEX1 P27695 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GAA P10253 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
SCHEMBL23398392 0.87 USP2 (0.49) LMNATSHRPOLBUSP2ALDH1A1
SCHEMBL23401766 0.86 ALDH1A1 (0.38) LMNATSHRPOLBALDH1A1L3MBTL1
SCHEMBL23398822 0.84 ALDH1A1 (0.45) LMNAALDH1A1MAPK1L3MBTL1NPC1
SCHEMBL23402716 0.84 USP2 (0.44) LMNATSHRPOLBUSP2KDM4C
SCHEMBL23400799 0.83 NR4A3 (0.46) LMNATSHRNR4A3POLBUSP2
SCHEMBL13360872 0.82 POLB (0.49) LMNATSHRNR4A3POLBALDH1A1
SCHEMBL23401061 0.82 CACNA1H (0.53) LMNATSHRPOLBUSP2ALDH1A1
SCHEMBL23401077 0.81 PDE4D (0.46) LMNATSHRALDH1A1L3MBTL1PDE4D
SCHEMBL23401710 0.80 NR4A3 (0.44) LMNATSHRNR4A3POLBALDH1A1
SCHEMBL23400415 0.79 POLB (0.50) LMNATSHRNR4A3POLBALDH1A1

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