SCHEMBL8638020

SCHEMBL8638020

CCN(CC)c1ccc2c(c1)OC(=O)C(=O)C2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.43
CA9 Q16790 4/20 0.43
ALDH1A1 P00352 11/20 0.41
KDM4E B2RXH2 6/20 0.41
L3MBTL1 Q9Y468 5/20 0.41
GLA P06280 3/20 0.41
MAPT P10636 6/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
HSD17B10 Q99714 4/20 0.40
CASP1 P29466 3/20 0.40
CASP7 P55210 3/20 0.40
HTT P42858 3/20 0.40
TP53 P04637 2/20 0.40
ALOX15 P16050 2/20 0.40
MPI P34949 1/20 0.40
BRCA1 P38398 1/20 0.40
RECQL P46063 1/20 0.40
CYP19A1 P11511 1/20 0.39
HPGD P15428 4/20 0.39

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
SCHEMBL13296463 0.84 TERT (0.43) CA12CA9ALDH1A1KDM4EL3MBTL1
SCHEMBL7750998 0.83 CA12 (0.40) CA12CA9ALDH1A1KDM4EL3MBTL1
Hydrochloric Acid SCHEMBL2475960 0.82 CA12 (0.44) CA12CA9ALDH1A1KDM4EL3MBTL1
SCHEMBL9341235 0.81 UTS2R (0.39)
SCHEMBL28936963 0.77 CA12 (0.46) CA12CA9ALDH1A1KDM4EL3MBTL1
SCHEMBL15488850 0.77 S100B (0.40) CA12CA9ALDH1A1KDM4EL3MBTL1
Nitric Acid SCHEMBL27979825 0.77 CRHBP (0.41) CA12CA9ALDH1A1KDM4EL3MBTL1
SCHEMBL13296930 0.76 ALDH1A1 (0.49) CA12CA9ALDH1A1KDM4EL3MBTL1
SCHEMBL11124199 0.74 ALDH1A1 (0.41) CA12CA9ALDH1A1KDM4EMEN1
SCHEMBL28980796 0.72 ALDH1A1 (0.39) CA12CA9ALDH1A1KDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0458485-B1 Image forming layer FUJI PHOTO FILM CO LTD (JP) 1998-07-29 EP disclosed
US-5395733-A Unsaturated polymer layer that can be decarboxylated on exposure to light and sensitizers FUJI PHOTO FILM CO., LTD. (JP) 1995-03-07 US disclosed
EP-0458485-A2 Image forming layer Fuji Photo Film Co., Ltd. (JP) 1991-11-27 EP disclosed
US-4946761-A POLYMER CONTAINING CARBOXYL END GROUPS FUJI PHOTO FILM CO., LTD. (JP) 1990-08-07 US disclosed