SCHEMBL7780277

SCHEMBL7780277

Nc1c(C(=O)O)cccc1N1CCC(Cc2ccccc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.60
HTT P42858 2/20 0.60
GFER P55789 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
CYP2C9 P11712 5/20 0.50
CYP2C19 P33261 5/20 0.50
MAPK14 Q16539 5/20 0.50
HTR2B P41595 3/20 0.50
KDM4E B2RXH2 1/20 0.49
MAPK1 P28482 1/20 0.49
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
PTPN1 P18031 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL7778035 0.85 HTR1A (0.53) MAPTHTTGFERSMN1; SMN2CYP2C9
SCHEMBL7780292 0.84 PTPN1 (0.46) MAPTHTTGFERSMN1; SMN2CYP2C9
SCHEMBL7778454 0.80 GAA (0.55) MAPTHTTSMN1; SMN2KDM4EMEN1
SCHEMBL10735472 0.78 MAPT (0.62) MAPTHTTGFERSMN1; SMN2CYP2C9
SCHEMBL7241763 0.78 MAPT (0.60) MAPTHTTGFERSMN1; SMN2CA12
SCHEMBL7778452 0.77 NPC1 (0.56) MAPTHTTGFERSMN1; SMN2KDM4E
SCHEMBL26155527 0.76 ALDH1A1 (0.60) MAPTHTTSMN1; SMN2KDM4EMAPK1
SCHEMBL26154619 0.76 ADRA2C (0.51) MAPTSMN1; SMN2KDM4EPTPN1MEN1
SCHEMBL7778442 0.76 NPC1 (0.58) MAPTHTTGFERSMN1; SMN2KDM4E
SCHEMBL7617666 0.75 MAPT (0.55) MAPTHTTGFERSMN1; SMN2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0781767-B1 Process for producing isatoic anhydrides SUMITOMO CHEMICAL CO (JP) 2001-09-05 EP disclosed
US-5981749-A Process for producing isatoic anhydrides SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-11-09 US disclosed
US-5973145-A Process for producing isatoic anhydrides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-10-26 US disclosed
US-5795984-A Process for producing isatoic anhydrides SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-08-18 US disclosed
EP-0781767-A1 Process for producing isatoic anhydrides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-02 EP disclosed