SCHEMBL6551916

SCHEMBL6551916

O=C(NC=Cc1ccc(O)cc1)c1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.80
NPC1 O15118 2/20 0.80
CYP3A4 P08684 3/20 0.57
KMT2A Q03164 3/20 0.57
PKM P14618 3/20 0.57
HSPD1 P10809 2/20 0.57
HSPE1 P61604 2/20 0.57
NFKB1 P19838 1/20 0.57
NFKB2 Q00653 1/20 0.57
RELA Q04206 1/20 0.57
MAPT P10636 4/20 0.55
ALDH1A1 P00352 1/20 0.55
ABCG2 Q9UNQ0 2/20 0.55
HDAC1 Q13547 3/20 0.51
HDAC2 Q92769 2/20 0.50
HDAC6 Q9UBN7 2/20 0.50
TTR P02766 1/20 0.50
MMP1 P03956 3/20 0.49
MMP2 P08253 3/20 0.49
MMP9 P14780 3/20 0.49

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
SCHEMBL15079020 0.89 NPC1 (1.00) RAB9ANPC1CYP3A4KMT2AMAPT
SCHEMBL3639135 0.89 NPC1 (1.00) RAB9ANPC1CYP3A4KMT2AMAPT
SCHEMBL7390245 0.89 NPC1 (1.00) RAB9ANPC1CYP3A4KMT2AMAPT
SCHEMBL21616520 0.85 NPC1 (0.77) RAB9ANPC1CYP3A4KMT2AMAPT
SCHEMBL21616489 0.85 NPC1 (0.77) RAB9ANPC1CYP3A4KMT2AMAPT
SCHEMBL23295225 0.85 NPC1 (0.77) RAB9ANPC1CYP3A4KMT2ANFKB1
SCHEMBL21616517 0.85 NPC1 (0.77) RAB9ANPC1CYP3A4KMT2ANFKB1
SCHEMBL23295216 0.85 NPC1 (0.77) RAB9ANPC1CYP3A4KMT2AMAPT
SCHEMBL23295215 0.85 NPC1 (0.77) RAB9ANPC1CYP3A4KMT2AMAPT
SCHEMBL19449789 0.85 NPC1 (0.77) RAB9ANPC1CYP3A4KMT2AMAPT

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
EP-1048457-B1 Lithographic printing plate precursor FUJI PHOTO FILM CO LTD (JP) 2004-12-15 EP disclosed
US-6455224-B1 SUPPORT WITH HYDROPHILIC SURFACE AND PHOTOSENSITIVE LAYER CONTAINING INFRARED ABSORBENT WHICH CHANGES FROM HYDROPHILIC TO HYDROPHOBIC BY HEAT AND HYDROPHILIC POLYMER HAVING FUNCTIONAL GROUP RENDERING LAYER WATER DEVELOPABLE FUJI PHOTO FILM CO., LTD. (JP) 2002-09-24 US disclosed
EP-1048457-A2 Lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2000-11-02 EP disclosed