SCHEMBL1019181

SCHEMBL1019181

c1coc(N2CCc3ccccc32)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.49
RAB9A P51151 5/20 0.49
TDP1 Q9NUW8 1/20 0.49
ROCK1 Q13464 2/20 0.46
SRD5A1 P18405 2/20 0.46
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
MAPK1 P28482 1/20 0.44
ALDH1A1 P00352 6/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
MAPT P10636 2/20 0.43
HTT P42858 2/20 0.43
POLB P06746 1/20 0.43
PKM P14618 1/20 0.43
NFKB1 P19838 1/20 0.43
CHRNA7 P36544 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
KMT2A Q03164 2/20 0.43
ALOX15 P16050 2/20 0.43

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
SCHEMBL12283641 0.79 SRD5A1 (0.50) SRD5A1LMNAMAPK1ALDH1A1HTT
SCHEMBL11459166 0.76 NPC1 (0.41) NPC1RAB9ATDP1MAPK1ALDH1A1
SCHEMBL9489951 0.72 KDM4E (0.37) NPC1RAB9ATDP1SRD5A1ALDH1A1
SCHEMBL8405088 0.71 ROCK1 (0.54) NPC1RAB9ATDP1ROCK1SRD5A1
SCHEMBL29264505 0.71 PIM1 (0.46) NPC1RAB9ATDP1ALDH1A1SMN1; SMN2
SCHEMBL29542545 0.71 ALDH1A1 (0.53) NPC1RAB9ATDP1ROCK1SRD5A1
SCHEMBL3905172 0.71 ALDH1A1 (0.53) NPC1RAB9ATDP1ROCK1SRD5A1
SCHEMBL1021868 0.70 CD74 (0.53) NPC1RAB9AROCK1SRD5A1LMNA
SCHEMBL11445531 0.70 ALDH1A1 (0.67) NPC1RAB9ATDP1LMNATP53
SCHEMBL19117986 0.69 SRD5A1 (0.56) NPC1RAB9AROCK1SRD5A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0010063-B1 PROCESS FOR THE PREPARATION OF FURANYL-BENZAZOLES CIBA-GEIGY AG (CH) 1982-12-29 EP claimed
EP-0010063-A2 Process for the preparation of furanyl-benzazoles CIBA-GEIGY AG (CH) 1980-04-16 EP claimed
EP-2271306-A1 DECORATIVE COSMETIC COMPOSITIONS Bayer MaterialScience AG (DE) 2011-01-12 EP disclosed
EP-2271305-A1 SUN PROTECTION COMPOSITIONS Bayer MaterialScience AG (DE) 2011-01-12 EP disclosed
WO-2009118103-A1 SUN PROTECTION COMPOSITIONS BAYER MATERIALSCIENCE AG (DE) 2009-10-01 WO disclosed
WO-2009118106-A1 DECORATIVE COSMETIC COMPOSITIONS BAYER MATERIALSCIENCE AG (DE) 2009-10-01 WO disclosed
EP-0010063-B1 PROCESS FOR THE PREPARATION OF FURANYL-BENZAZOLES CIBA-GEIGY AG (CH) 1982-12-29 EP disclosed
EP-0010063-B1 PROCESS FOR THE PREPARATION OF FURANYL-BENZAZOLES CIBA-GEIGY AG (CH) 1982-12-29 EP disclosed
EP-0010063-A2 Process for the preparation of furanyl-benzazoles CIBA-GEIGY AG (CH) 1980-04-16 EP disclosed
EP-0010063-A2 Process for the preparation of furanyl-benzazoles CIBA-GEIGY AG (CH) 1980-04-16 EP disclosed
EP-0010063-A2 Process for the preparation of furanyl-benzazoles CIBA-GEIGY AG (CH) 1980-04-16 EP disclosed