SCHEMBL19864469

SCHEMBL19864469

CCCc1ccc(COc2ccc(C)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.57
PARP10 Q53GL7 1/20 0.56
NPC1 O15118 3/20 0.54
RAB9A P51151 3/20 0.54
CASP3 P42574 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
HRH3 Q9Y5N1 2/20 0.53
ALDH1A1 P00352 1/20 0.53
MAPT P10636 1/20 0.53
MAPK1 P28482 1/20 0.53
KCNH2 Q12809 1/20 0.49
APP P05067 1/20 0.48
FFAR1 O14842 1/20 0.48

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
SCHEMBL14409728 0.95 MAOB (0.53) MAOBPARP10NPC1RAB9ACASP3
SCHEMBL16440937 0.92 APP (0.56) MAOBSENP8SENP7SENP6HRH3
SCHEMBL24701846 0.90 MAOB (0.62) MAOBPARP10NPC1RAB9ACASP3
SCHEMBL13637020 0.90 MAOB (0.62) MAOBPARP10NPC1RAB9ACASP3
SCHEMBL13483788 0.89 HRH3 (0.55) MAOBPARP10NPC1RAB9ACASP3
SCHEMBL8929713 0.88 MAOB (0.69) MAOBPARP10NPC1RAB9ACASP3
SCHEMBL891195 0.88 MAOB (0.69) MAOBPARP10NPC1RAB9ACASP3
SCHEMBL762195 0.88 MAOB (0.69) MAOBPARP10NPC1RAB9ACASP3
SCHEMBL8930213 0.88 MAOB (0.69) MAOBPARP10NPC1RAB9ACASP3
SCHEMBL12040563 0.87 HRH3 (0.61) MAOBPARP10NPC1RAB9ACASP3

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
WO-2018031410-A2 HETEROCYCLIC LIQUID CRYSTAL COMPOSITION, REVERSE-MODE POLYMER DISPERSED LIQUID CRYSTAL ELEMENT, AND ASSOCIATED SELECTIVELY DIMMABLE DEVICE NITTO DENKO CORPORATION (JP) 2018-02-15 WO disclosed