SCHEMBL4877612

SCHEMBL4877612

CN(C)[C](c1ccccc1)c1ccccc1N(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
MAPT P10636 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
GAA P10253 2/20 0.53
TP53 P04637 1/20 0.53
TSHR P16473 1/20 0.53
RAB9A P51151 2/20 0.41
CNR2 P34972 2/20 0.38
HPGD P15428 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NPC1 O15118 1/20 0.37
HSP90AA1 P07900 1/20 0.36
HIF1A Q16665 1/20 0.36
HTR6 P50406 1/20 0.35
GFER P55789 1/20 0.35
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34

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
SCHEMBL375035 0.78 ALDH1A1 (0.62) ALDH1A1MAPTSMN1; SMN2GAATP53
SCHEMBL5340218 0.78 ALDH1A1 (0.56) ALDH1A1MAPTTSHRRAB9AHPGD
SCHEMBL28060104 0.78 ALDH1A1 (0.55) ALDH1A1MAPTSMN1; SMN2GAATP53
Hydrochloric Acid SCHEMBL9403739 0.77 ALDH1A1 (0.60) ALDH1A1MAPTSMN1; SMN2GAATP53
SCHEMBL7673917 0.76 ALDH1A1 (0.53) ALDH1A1MAPTSMN1; SMN2GAATP53
SCHEMBL9126623 0.76 MEN1 (0.55) ALDH1A1MAPTSMN1; SMN2GAATP53
SCHEMBL501813 0.76 MAPT (0.77) ALDH1A1MAPTSMN1; SMN2GAATP53
SCHEMBL29384309 0.76 MAPT (0.77) ALDH1A1MAPTSMN1; SMN2GAATP53
SCHEMBL10931124 0.76 ALDH1A1 (0.53) ALDH1A1MAPTSMN1; SMN2GAATP53
SCHEMBL5828459 0.76 ALDH1A1 (0.53) ALDH1A1MAPTSMN1; SMN2GAATP53

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-20080107905-A1 crosslinked rubber layer containing a copolymer of acrylonitrile, butadiene modified with monobutyl maleate or itaconate, a modified polyethyl acrylate or copolymer with acrylonitrile, a hexamethylenediamine carbamate crosslinker, a phosphonium benzotriazole salt, a fluoropolymer; oil, ozone resistance ZEON CORPORATION (JP) 2008-05-08 US disclosed
EP-1795341-A1 LAYERED RUBBER PRODUCT ZEON CORPORATION (JP) 2007-06-13 EP disclosed