SCHEMBL1033795

SCHEMBL1033795

CCCCc1ccc(-c2c(N)ccc(-c3ccc(-c4ccc(N)cc4)cc3)c2-c2ccc(CCCC)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.44
RARB P10826 6/20 0.42
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KMT2A Q03164 2/20 0.41
USP2 O75604 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 2/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
HTR2A P28223 1/20 0.40
HSD11B1 P28845 1/20 0.39
MAOB P27338 2/20 0.39
CA2 P00918 1/20 0.37

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
SCHEMBL10705373 0.98 SKP2 (0.45) SKP2RARBRAB9ASMN1; SMN2MAPT
SCHEMBL4621460 0.86 SKP2 (0.56) SKP2RARBRAB9ASMN1; SMN2MAPT
SCHEMBL10706144 0.83 TAAR1 (0.38) RAB9ASMN1; SMN2MAPTKDM4EHSD17B10
SCHEMBL15198798 0.82 RARB (0.56) SKP2RARBRAB9ASMN1; SMN2MAPT
SCHEMBL4908052 0.80 HSD11B1 (0.45) SKP2RARBRAB9ASMN1; SMN2MAPT
SCHEMBL1076315 0.80 SKP2 (0.54) SKP2RARBRAB9ASMN1; SMN2MAPT
SCHEMBL4883483 0.79 SKP2 (0.40) SKP2RARBRAB9ASMN1; SMN2MAPT
SCHEMBL19253102 0.79 HTR2A (0.58) SKP2RARBRAB9ASMN1; SMN2MAPT
SCHEMBL18889618 0.79 TDP1 (0.46) RAB9ASMN1; SMN2MAPTKDM4EHSD17B10
SCHEMBL29756035 0.79 TDP1 (0.46) RAB9ASMN1; SMN2MAPTKDM4EHSD17B10

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
EP-1850185-B1 Imaging member, method of imaging using it and method of making said imaging member XEROX CORP (US) 2011-01-19 EP claimed