SCHEMBL27720598

SCHEMBL27720598

C=C(OCCCCc1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
TDP1 Q9NUW8 3/20 0.47
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
RECQL P46063 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
IDO1 P14902 1/20 0.44
FFAR1 O14842 1/20 0.44
MAOA P21397 1/20 0.42
PLA2G4B P0C869 1/20 0.42
MAPT P10636 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
NAAA Q02083 1/20 0.42

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
SCHEMBL28483245 0.87 ESR1 (0.50) LMNATDP1NPC1RAB9ASMN1; SMN2
SCHEMBL3821882 0.79 TDP1 (0.79) LMNATDP1NPC1RAB9ARECQL
SCHEMBL2539792 0.78 TSHR (0.50) LMNATDP1RAB9ASMN1; SMN2MAPT
SCHEMBL16673090 0.77 TDP1 (0.76) LMNATDP1NPC1RAB9ARECQL
SCHEMBL6232820 0.77 TDP1 (0.76) LMNATDP1NPC1RAB9ARECQL
SCHEMBL8896400 0.76 LMNA (0.61) LMNATDP1NPC1RAB9ARECQL
SCHEMBL28444213 0.76 LMNA (0.56) LMNATDP1NPC1RAB9ARECQL
SCHEMBL982156 0.76 LMNA (0.65) LMNATDP1NPC1RAB9ARECQL
SCHEMBL1553490 0.76 LMNA (0.65) LMNATDP1NPC1RAB9ARECQL
SCHEMBL27899569 0.76 TSHR (0.48) LMNATDP1SMN1; SMN2MAPT

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
CN-101128424-A Indole compound and use thereof ONO PHARMACEUTICAL CO (JP) 2008-02-20 CN disclosed