SCHEMBL5899557

SCHEMBL5899557

C=CC(=O)Oc1ccc(C(C)(C)c2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.52
RAB9A P51151 3/20 0.52
MAOB P27338 1/20 0.50
KDM4E B2RXH2 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
ALDH1A1 P00352 2/20 0.49
NR4A2 P43354 2/20 0.49
RXRA P19793 1/20 0.49
RXRB P28702 1/20 0.49
NR4A1 P22736 1/20 0.49
NR4A3 Q92570 1/20 0.49
GAA P10253 1/20 0.48
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
THRB P10828 1/20 0.47
PARP10 Q53GL7 1/20 0.47
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
PTGS1 P23219 1/20 0.46

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
SCHEMBL28010934 0.89 NR4A1 (0.60) NPC1RAB9AMAOBKDM4ESMN1; SMN2
SCHEMBL5899573 0.88 THRB (0.63) NPC1RAB9AMAOBKDM4ESMN1; SMN2
SCHEMBL813584 0.86 KDM4E (0.51) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL5899577 0.85 LMNA (0.48) NPC1RAB9AMAOBKDM4ESMN1; SMN2
SCHEMBL24844714 0.84 FFAR1 (0.55) MAOBALDH1A1NR4A2NR4A1NR4A3
SCHEMBL9572979 0.84 NPC1 (0.54) NPC1RAB9AMAOBKDM4ESMN1; SMN2
SCHEMBL202339 0.83 THRB (0.54) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL2584694 0.83 THRB (0.54) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL10013799 0.83 LMNA (0.60) NPC1RAB9AMAOBSMN1; SMN2NR4A2
SCHEMBL5899655 0.82 TGM2 (0.48) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1

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-20060261318-A1 Light control film SUMITOMO CHEMICAL COMPANY, LIMITED 2006-11-23 US disclosed