SCHEMBL9742202

SCHEMBL9742202

CCCc1cc(O)c(CC)c(O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.59
NPC1 O15118 1/20 0.59
HPGD P15428 1/20 0.59
MAPK1 P28482 1/20 0.59
RAB9A P51151 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
CNR1 P21554 1/20 0.54
CNR2 P34972 1/20 0.54
TRPA1 O75762 1/20 0.43
ALDH1A1 P00352 1/20 0.42
ALOX5 P09917 1/20 0.42
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 1/20 0.41
DRD2 P14416 1/20 0.41
TSHR P16473 1/20 0.41
NFKB1 P19838 1/20 0.41
DRD1 P21728 1/20 0.41
DRD4 P21917 1/20 0.41
DRD5 P21918 1/20 0.41
ADRA1D P25100 1/20 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
SCHEMBL27930403 0.90 NPC1 (0.58) HTTNPC1HPGDMAPK1RAB9A
SCHEMBL1179405 0.88 HTT (0.68) HTTNPC1HPGDMAPK1RAB9A
SCHEMBL27861750 0.87 HTT (0.57) HTTNPC1HPGDMAPK1RAB9A
SCHEMBL9745357 0.86 NPC1 (0.80) HTTNPC1HPGDMAPK1RAB9A
SCHEMBL31545718 0.86 HTT (0.59) HTTNPC1HPGDMAPK1RAB9A
SCHEMBL1179394 0.82 TRPA1 (0.54) HTTNPC1HPGDMAPK1RAB9A
SCHEMBL9745513 0.82 HTT (0.88) HTTNPC1HPGDMAPK1RAB9A
SCHEMBL16527769 0.82 CNR1 (0.61) HTTNPC1HPGDMAPK1RAB9A
SCHEMBL9745054 0.81 NPC1 (0.59) HTTNPC1HPGDMAPK1RAB9A
SCHEMBL23387402 0.80 HTT (0.59) HTTNPC1HPGDMAPK1RAB9A

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