SCHEMBL11197834

SCHEMBL11197834

CCN(CC)c1ccc(C(OC)(C(=O)O)c2ccc(N(CC)CC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
NOX1 Q9Y5S8 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
CNR2 P34972 2/20 0.42
ALDH1A1 P00352 6/20 0.42
TSHR P16473 4/20 0.42
HTT P42858 2/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH3A1 P30838 1/20 0.42
ALDH1A3 P47895 1/20 0.42
AOC3 Q16853 1/20 0.41
POLB P06746 2/20 0.40
HPGD P15428 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
FGFR1 P11362 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
SCHEMBL11185040 0.81 MEN1 (0.58) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL11192249 0.81 SLC2A1 (0.48) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL10471625 0.77 MEN1 (0.49) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL9345320 0.77 MEN1 (0.53) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL10473985 0.76 MEN1 (0.47) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL11793591 0.74 ALDH1A1 (0.48) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL340836 0.74 KCNN4 (0.52) MAPTKMT2AALDH1A1TSHRMAPK1
SCHEMBL10473739 0.73 MEN1 (0.45) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL6785896 0.73 KCNN4 (0.44) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL7876582 0.73 MEN1 (0.47) MAPTMEN1KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4343939-A COLOR FORMERS FOR USE IN TRANSFER SETS AMERICAN CYANAMID COMPANY (US) 1982-08-10 US claimed
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