SCHEMBL9803154

SCHEMBL9803154

Cc1cc2cc3c(=O)c(C)c(C)cc-3oc2cc1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.36
MEN1 O00255 2/20 0.33
POLB P06746 2/20 0.33
KMT2A Q03164 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
HSD17B3 P37058 1/20 0.33
KDM4E B2RXH2 1/20 0.33
AKR1B10 O60218 1/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ABL1 P00519 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
AKR1B1 P15121 1/20 0.33
HPGD P15428 1/20 0.33
ALOX12 P18054 1/20 0.33
MPI P34949 1/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL895784 0.80 KMT2A (0.49) MEN1POLBKMT2ATDP1CTDSP1
SCHEMBL15842923 0.69 HSD17B3 (0.60) ADORA3HSD17B3ALDH1A1HPGDPON1
SCHEMBL12231776 0.64 HSD17B3 (0.42) ADORA3MEN1KMT2AHSD17B3ALDH1A1
SCHEMBL862531 0.64 DYRK1A (0.42) ADORA3MEN1POLBKMT2ATDP1
SCHEMBL26035476 0.63 HSD17B3 (0.44) ADORA3HSD17B3MAPTPON1MAOB
SCHEMBL11341818 0.62 SIRT1 (0.61) MEN1POLBKMT2AHSD17B3KDM4E
SCHEMBL8036025 0.62 ALDH1A1 (0.62) MEN1KMT2ATDP1HSD17B3KDM4E
Iodide SCHEMBL10899799 0.61 MAOB (0.42) MAOBMAOA
SCHEMBL9160537 0.61 RAB9A (0.47) MEN1POLBKMT2ATDP1CTDSP1
SCHEMBL12509825 0.61 HSD17B3 (0.33) HSD17B3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0203030-B1 COATED MATERIAL AND ITS USE CIBA-GEIGY AG (CH) 1991-03-20 EP disclosed
EP-0182745-B1 POLYIMIDES, PROCESS FOR THEIR FABRICATION, AND THEIR USE CIBA-GEIGY AG (CH) 1990-11-22 EP disclosed
EP-0203030-A2 Coated material and its use CIBA-GEIGY AG (CH) 1986-11-26 EP disclosed
EP-0200680-A2 Coated material and its use CIBA-GEIGY AG (CH) 1986-11-05 EP disclosed
EP-0182745-A2 Polyimides, process for their fabrication, and their use CIBA-GEIGY AG (CH) 1986-05-28 EP disclosed
EP-0181837-A2 Process for the manufacture of films and relief pictures from polyimides CIBA-GEIGY AG (CH) 1986-05-21 EP disclosed