SCHEMBL9056784

SCHEMBL9056784

CCCCc1[c]cc(CCCC)c(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.50
ALOX5 P09917 4/20 0.43
HTT P42858 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 2/20 0.43
CYP3A4 P08684 2/20 0.43
TP53 P04637 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAPK1 P28482 2/20 0.40
NPC1 O15118 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
GAA P10253 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL4656377 0.83 TYR (0.52) TYRALOX5HTTMEN1KMT2A
SCHEMBL28045776 0.81 TYR (0.50) TYRALOX5HTTMEN1KMT2A
SCHEMBL8848639 0.76 ALOX5 (0.54) TYRALOX5HTTMEN1KMT2A
SCHEMBL27462834 0.76 TYR (0.33) TYR
SCHEMBL184986 0.76 CDK1 (0.39) TYRHTTMAPK1NPC1HPGD
SCHEMBL156399 0.75 TYR (0.65) TYRALOX5HTTMEN1KMT2A
SCHEMBL10671033 0.75 ALOX5 (0.49) TYRALOX5HTTMEN1KMT2A
SCHEMBL3382419 0.73 TYR (0.63) TYRALOX5HTTMEN1KMT2A
SCHEMBL10790730 0.71 TYR (0.61) TYRALOX5HTTMEN1KMT2A
SCHEMBL28932575 0.71 HMGCR (0.46) TYRALOX5HTTMEN1KMT2A

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-1996013264-A1 ORAL HYPOGLYCEMIC AGENTS ELI LILLY AND COMPANY (US) 1996-05-09 WO disclosed