SCHEMBL11467604

SCHEMBL11467604

CC(C)CN=Cc1ccc(O)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
KMT2A Q03164 2/20 0.58
MIF P14174 7/20 0.50
MAPT P10636 1/20 0.50
TAAR1 Q96RJ0 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
CA2 P00918 4/20 0.46
GFER P55789 1/20 0.42
CA1 P00915 2/20 0.41
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ESRRG P62508 1/20 0.40
S100B P04271 1/20 0.40

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
SCHEMBL11467602 1.00 ALDH1A1 (0.58) ALDH1A1KMT2AMIFMAPTTAAR1
SCHEMBL15706619 0.83 ALDH1A1 (0.58) ALDH1A1KMT2AMIFMAPTTAAR1
SCHEMBL7519008 0.80 NPC1 (0.39) ALDH1A1KMT2AMIFMAPTTAAR1
SCHEMBL7519004 0.80 NPC1 (0.39) ALDH1A1KMT2AMIFMAPTTAAR1
SCHEMBL8934289 0.80 CYP1A2 (0.43) ALDH1A1KMT2AMAPTTAAR1NPC1
SCHEMBL7936118 0.79 NPC1 (0.49) KMT2ATAAR1NPC1RAB9ACA2
SCHEMBL8415809 0.79 NPC1 (0.49) KMT2ATAAR1NPC1RAB9ACA2
SCHEMBL8415811 0.79 NPC1 (0.49) KMT2ATAAR1NPC1RAB9ACA2
SCHEMBL22340453 0.77 CYP1A2 (0.47) ALDH1A1KMT2AMAPTTAAR1CA2
SCHEMBL4604384 0.77 ALDH1A1 (0.50) ALDH1A1KMT2AMIFMAPTTAAR1

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-4214094-A ANTILIPEMIC AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-07-22 US disclosed