SCHEMBL11053315

SCHEMBL11053315

CCOc1ccc(NC(=O)COc2ccc(NC(=O)c3cc(C(=O)O)c4c(C(=O)O)ccc5c6ccc(C(=O)O)c7c(C(=O)O)ccc(c3c45)c76)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
KDM4E B2RXH2 3/20 0.52
ALDH1A1 P00352 2/20 0.52
MAPK1 P28482 2/20 0.52
MEN1 O00255 8/20 0.47
KMT2A Q03164 8/20 0.47
RAB9A P51151 6/20 0.46
NPC1 O15118 6/20 0.46
POLB P06746 4/20 0.46
ATM Q13315 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
GPR55 Q9Y2T6 1/20 0.46
GAA P10253 1/20 0.46
ALOX15 P16050 1/20 0.46
APOBEC3A P31941 1/20 0.45
APOBEC3G Q9HC16 1/20 0.45
TAS1R3 Q7RTX0 1/20 0.45
TAS1R1 Q7RTX1 1/20 0.45
HTT P42858 2/20 0.45

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
SCHEMBL10708495 0.85 KDM4E (0.57) MAPTSMN1; SMN2KDM4EALDH1A1MAPK1
SCHEMBL10710500 0.77 MEN1 (0.48) MAPTSMN1; SMN2KDM4EALDH1A1MAPK1
SCHEMBL11346627 0.74 MEN1 (0.48) MAPTSMN1; SMN2KDM4EALDH1A1MAPK1
SCHEMBL10594598 0.72 KMT2A (0.82) MAPTSMN1; SMN2KDM4EALDH1A1MAPK1
SCHEMBL9323158 0.72 NPC1 (0.54) SMN1; SMN2ALDH1A1MEN1KMT2ARAB9A
SCHEMBL18103399 0.71 NPC1 (0.53) MAPTSMN1; SMN2KDM4EALDH1A1MAPK1
SCHEMBL5017093 0.71 ALDH1A1 (0.46) MAPTSMN1; SMN2KDM4EALDH1A1MEN1
SCHEMBL7828898 0.70 RAB9A (0.74) MAPTSMN1; SMN2KDM4EALDH1A1MAPK1
SCHEMBL10708453 0.68 RAB9A (0.50) MAPTSMN1; SMN2KDM4EALDH1A1MEN1
SCHEMBL823150 0.68 RAB9A (0.50) MAPTSMN1; SMN2KDM4EALDH1A1MEN1

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
US-4217455-A Preparation of transparent and easily dispersible perylene-3,4,9,10-tetracarboxylic acid diimide pigments of high tinctorial strength BASF AKTIENGESELLSCHAFT (DE) 1980-08-12 US claimed
US-4459233-A Purification of crude organic pigments BASF AKTIENGESELLSCHAFT (DE) 1984-07-10 US disclosed
US-4217455-A Preparation of transparent and easily dispersible perylene-3,4,9,10-tetracarboxylic acid diimide pigments of high tinctorial strength BASF AKTIENGESELLSCHAFT (DE) 1980-08-12 US disclosed
US-4217455-A Preparation of transparent and easily dispersible perylene-3,4,9,10-tetracarboxylic acid diimide pigments of high tinctorial strength BASF AKTIENGESELLSCHAFT (DE) 1980-08-12 US disclosed
US-4115386-A Perylene-3,4,9,10-tetracarboxylic acid diimide pigment, its manufacture and its use BASF AKTIENGESELLSCHAFT (DE) 1978-09-19 US disclosed