SCHEMBL8638975

SCHEMBL8638975

Cc1ccc(C(=O)Oc2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.63
NR4A1 P22736 1/20 0.62
NR4A2 P43354 1/20 0.62
NR4A3 Q92570 1/20 0.62
PARP10 Q53GL7 2/20 0.60
LMNA P02545 1/20 0.58
SRD5A2 P31213 1/20 0.57
ALDH1A1 P00352 2/20 0.57
MAPT P10636 1/20 0.57
MAPK1 P28482 1/20 0.57
SCN2A Q99250 1/20 0.56
PLA2G4B P0C869 1/20 0.55
RXRA P19793 1/20 0.54
RXRB P28702 1/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
EGFR P00533 2/20 0.53
HIF1A Q16665 1/20 0.53
HDAC3 O15379 1/20 0.52

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
SCHEMBL13612596 1.00 MAOB (0.63) MAOBNR4A1NR4A2NR4A3PARP10
SCHEMBL23084938 0.92 MAOB (0.71) MAOBPARP10LMNAALDH1A1MAPT
SCHEMBL12353112 0.92 MAOB (0.71) MAOBPARP10LMNAALDH1A1MAPT
SCHEMBL25500912 0.92 MAOB (0.71) MAOBPARP10LMNAALDH1A1MAPT
SCHEMBL12353119 0.92 MAOB (0.71) MAOBPARP10LMNAALDH1A1MAPT
SCHEMBL4811757 0.91 NR4A2 (0.70) MAOBNR4A1NR4A2NR4A3PARP10
SCHEMBL6444707 0.89 NR4A2 (0.67) MAOBNR4A1NR4A2NR4A3PARP10
SCHEMBL9735930 0.88 MAOB (0.68) MAOBNR4A1NR4A2NR4A3PARP10
SCHEMBL17212838 0.88 KMT2A (0.63) PARP10LMNAALDH1A1MAPTL3MBTL1
SCHEMBL9185731 0.88 NR4A2 (0.81) MAOBNR4A1NR4A2NR4A3PARP10

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
US-5804097-A HAVING HIGH FLOW VISCOSITY, GOOD MISCIBILITY WITH OTHER LIQUID CRYSTALS BASF AKTIENGSELLSCHAFT (DE) 1998-09-08 US disclosed