SCHEMBL8197824

SCHEMBL8197824

COc1cccc(-c2cc(OC)c3ccccc3c2)c1C(=O)N(C(C)C)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GPR84 Q9NQS5 1/20 0.39
TSHR P16473 1/20 0.39
PTPRC P08575 1/20 0.39
PTPN1 P18031 1/20 0.39
DHODH Q02127 1/20 0.38
ERN1 O75460 1/20 0.38
BCL2L1 Q07817 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
HTT P42858 1/20 0.38
ADORA3 P0DMS8 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL7745294 0.71 BCAT2 (0.49) ALDH1A1MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL8196128 0.71 TSHR (0.41) ALDH1A1MEN1MAPTKMT2ATSHR
SCHEMBL8197756 0.70 NQO1 (0.54) ALDH1A1MAPTRAB9ASMN1; SMN2ERN1
SCHEMBL8193018 0.70 TSHR (0.41) ALDH1A1MEN1MAPTKMT2ATSHR
SCHEMBL8200174 0.69 ENPP2 (0.47) ALDH1A1MAPTKMT2ASMN1; SMN2CA12
SCHEMBL21824069 0.69 ENPP2 (0.47) ALDH1A1MEN1MAPTRAB9AKMT2A
SCHEMBL29456755 0.69 KIT (0.44) ALDH1A1MEN1MAPTRAB9AKMT2A
SCHEMBL29169701 0.68 L3MBTL1 (0.47) ALDH1A1MEN1MAPTRAB9AKMT2A
SCHEMBL14052509 0.67 SMN1; SMN2 (0.54) ALDH1A1MEN1MAPTRAB9AKMT2A
SCHEMBL8197617 0.66 HPGD (0.50) ALDH1A1RAB9AKMT2AHPGDL3MBTL1

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
US-6103912-A OPTICAL INFRARED FILTERS COMPRISING PH SENSITIVE DYES POLAROID CORPORATION (US) 2000-08-15 US disclosed
EP-0553346-B1 PHOTOGRAPHIC PRODUCTS AND PROCESSES POLAROID CORP (US) 1998-01-28 EP disclosed
US-5244771-A Bridged indicator dyes used as light-absorbing, pH-sensitive optical filter agents in diffusion transfer POLAROID CORPORATION (US) 1993-09-14 US disclosed
WO-1993004403-A1 PHOTOGRAPHIC PRODUCTS AND PROCESSES POLAROID CORPORATION (US) 1993-03-04 WO disclosed