SCHEMBL11192249

SCHEMBL11192249

COC(C(=O)O)(c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.48
ALDH1A1 P00352 9/20 0.44
MAPT P10636 6/20 0.44
HPGD P15428 5/20 0.44
RAB9A P51151 4/20 0.43
NPC1 O15118 3/20 0.43
HSD17B3 P37058 1/20 0.42
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HSD17B10 Q99714 3/20 0.41
TSHR P16473 2/20 0.41
ALOX15 P16050 1/20 0.41
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ESR2 Q92731 1/20 0.40
NOX1 Q9Y5S8 1/20 0.40
POLB P06746 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL11197834 0.81 MAPT (0.50) ALDH1A1MAPTHPGDRAB9ANPC1
SCHEMBL10334655 0.80 SLC2A1 (0.43) SLC2A1ALDH1A1MAPTHPGDRAB9A
SCHEMBL340836 0.78 KCNN4 (0.52) ALDH1A1MAPTTSHRALOX15KMT2A
SCHEMBL7876582 0.77 MEN1 (0.47) MAPTHPGDRAB9ANPC1TSHR
SCHEMBL6785896 0.77 KCNN4 (0.44) ALDH1A1MAPTRAB9ANPC1GAA
SCHEMBL11442181 0.77 KMT2A (0.40) MAPTHPGDRAB9ANPC1L3MBTL1
Ammonia Solution, Strong SCHEMBL9292403 0.76 KCNN4 (0.50) ALDH1A1MAPTTSHRALOX15KMT2A
Hydrochloric Acid SCHEMBL8044029 0.76 KCNN4 (0.50) ALDH1A1MAPTTSHRALOX15KMT2A
SCHEMBL27815694 0.76 SLC2A1 (0.43) SLC2A1ALDH1A1MAPTHPGDRAB9A
SCHEMBL4678223 0.75 SLC2A1 (0.54) SLC2A1ALDH1A1MAPTHPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4403792-A PRESSURE SENSITIVE TRANSFER SHEETS AMERICAN CYANAMID COMPANY (US) 1983-09-13 US disclosed
US-4343939-A COLOR FORMERS FOR USE IN TRANSFER SETS AMERICAN CYANAMID COMPANY (US) 1982-08-10 US disclosed