SCHEMBL9744115

SCHEMBL9744115

CCCCc1c(O)cc(CC)cc1O

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.80
HPGD P15428 1/20 0.80
MAPK1 P28482 1/20 0.80
HTT P42858 1/20 0.80
RAB9A P51151 1/20 0.80
NPSR1 Q6W5P4 1/20 0.80
KDM4E B2RXH2 2/20 0.50
PKM P14618 1/20 0.50
SLC28A3 Q9HAS3 1/20 0.47
TRPA1 O75762 1/20 0.45
CYP19A1 P11511 1/20 0.44
IAPP P10997 1/20 0.43
TYR P14679 1/20 0.42
PPARA Q07869 1/20 0.42
PTGS2 P35354 3/20 0.42
CYP3A4 P08684 2/20 0.42
SKP2 Q13309 1/20 0.41
IGF1R P08069 1/20 0.41
ALOX15 P16050 1/20 0.41
ESR1 P03372 2/20 0.41

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
SCHEMBL9744288 0.89 HTT (1.00) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL27930400 0.89 NPC1 (0.91) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL9745513 0.87 HTT (0.88) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL9745054 0.86 NPC1 (0.59) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL20477532 0.85 HTT (0.92) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL18782422 0.85 HTT (0.92) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL9743684 0.83 NPC1 (0.88) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL9745357 0.83 NPC1 (0.80) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL27693672 0.83 HTT (0.88) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL9743295 0.82 HTT (0.72) NPC1HPGDMAPK1HTTRAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5087548-A POSITIVE TYPE RADIATION-SENSITIVE RESIN COMPOSITION JAPAN SYNTHETIC RUBBER CO., INC. (JP) 1992-02-11 US disclosed
EP-0227487-A2 Positive type radiation-sensitive resin composition JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1987-07-01 EP disclosed