SCHEMBL9794835

SCHEMBL9794835

CCCCCCCCc1cnc(-c2ccc(OCC(C)OCC)cc2)nc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.53
RAB9A P51151 7/20 0.50
MAPT P10636 5/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
KDM4E B2RXH2 2/20 0.50
HSD17B10 Q99714 2/20 0.50
MEN1 O00255 1/20 0.50
USP2 O75604 1/20 0.50
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NPC1 O15118 5/20 0.46
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
S1PR1 P21453 3/20 0.40
STAT3 P40763 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
SCHEMBL9794759 0.93 RARB (0.56) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9794789 0.92 RARB (0.55) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9134427 0.92 RARB (0.52) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9794849 0.92 RARB (0.55) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9132441 0.92 RARB (0.52) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL10702589 0.91 RARB (0.54) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9488880 0.87 RAB9A (0.52) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9488457 0.87 RAB9A (0.52) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL10705019 0.87 RARB (0.49) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9514938 0.86 S1PR1 (0.49) RARBRAB9AMAPTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5021191-A Ferroelectricity display elements; extremely small redution in crystal temperature region CHISSO CORPORATION (JP) 1991-06-04 US disclosed