SCHEMBL6985459

SCHEMBL6985459

CCOc1cc(C(C)O)cc2oc(=O)c(C(=O)c3cc4ccccc4o3)cc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.51
RAB9A P51151 4/20 0.48
NPC1 O15118 3/20 0.48
LMNA P02545 2/20 0.44
ALDH1A1 P00352 6/20 0.43
KDM4E B2RXH2 4/20 0.43
MAOB P27338 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAOA P21397 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
FLT3 P36888 1/20 0.41
TSHR P16473 2/20 0.41
MEN1 O00255 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
PPARG P37231 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
SCHEMBL4567099 0.86 POLB (0.54) POLBRAB9ANPC1LMNAALDH1A1
SCHEMBL11096112 0.86 POLB (0.54) POLBRAB9ANPC1LMNAALDH1A1
SCHEMBL10703662 0.73 FLT3 (0.71) RAB9ANPC1LMNAALDH1A1KDM4E
SCHEMBL194000 0.71 ALDH1A1 (0.52) POLBRAB9ANPC1LMNAALDH1A1
SCHEMBL52081 0.70 ALDH1A1 (0.68) POLBRAB9ANPC1LMNAALDH1A1
SCHEMBL6838345 0.69 ALDH1A1 (0.51) POLBRAB9ANPC1ALDH1A1KDM4E
SCHEMBL210314 0.68 POLB (0.63) POLBRAB9ANPC1LMNAALDH1A1
SCHEMBL5940591 0.68 MEN1 (0.55) POLBRAB9ANPC1LMNAALDH1A1
Water SCHEMBL28341685 0.67 POLB (0.61) POLBRAB9ANPC1LMNAALDH1A1
SCHEMBL6836275 0.67 ALDH1A1 (0.72) POLBRAB9ANPC1LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120121815-A1 METHOD OF PHOTOPOLYMERIZING OF ACRYLATES KODAK (NEAR EAST) INC. 2012-05-17 US disclosed
US-20120122664-A1 PHOTOINITIATOR COMPOSITIONS PAKON, INC. 2012-05-17 US disclosed
US-20120123010-A1 PHOTOCURABLE COMPOSITIONS FAR EAST DEVELOPMENT LTD. 2012-05-17 US disclosed