SCHEMBL6237186

SCHEMBL6237186

CCCCCCCCCCCCCCC(=O)Nc1cccs1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CETP P11597 1/20 0.51
SOAT1 P35610 3/20 0.50
LMNA P02545 2/20 0.50
POLB P06746 2/20 0.50
SOAT2 O75908 1/20 0.50
EP300 Q09472 1/20 0.49
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MEN1 O00255 2/20 0.48
GAA P10253 2/20 0.48
KMT2A Q03164 2/20 0.48
ALOX15 P16050 2/20 0.48
USP2 O75604 1/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
HTT P42858 1/20 0.48
HSD17B10 Q99714 1/20 0.48
EPHX2 P34913 1/20 0.48
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL11204255 0.98 MEN1 (0.49) CETPSOAT1LMNAPOLBSOAT2
SCHEMBL11199473 0.94 MEN1 (0.50) CETPLMNAPOLBNPC1RAB9A
SCHEMBL6464495 0.87 ADORA2A (0.56) LMNAPOLBNPC1RAB9ASMN1; SMN2
SCHEMBL3422728 0.80 GAA (0.55) LMNAPOLBNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL28317066 0.78 GAA (0.54) LMNAPOLBNPC1RAB9ASMN1; SMN2
SCHEMBL8938895 0.78 L3MBTL1 (0.50) LMNAPOLBNPC1RAB9ASMN1; SMN2
SCHEMBL9784530 0.76 USP2 (0.82) LMNAPOLBMEN1GAAKMT2A
SCHEMBL27489667 0.76 GAA (0.47) LMNAPOLBNPC1RAB9ASMN1; SMN2
SCHEMBL5878480 0.75 CETP (0.77) CETPSOAT1LMNASOAT2EP300
SCHEMBL9395051 0.75 CETP (0.77) CETPSOAT1LMNASOAT2EP300

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
WO-2005014693-A1 METHOD OF CROSSLINKING INTRINSICALLY CONDUCTIVE POLYMERS OR INTRINSICALLY CONDUCTIVE POLYMER PRECURSORS AND THE ARTICLES OBTAINED THEREFROM UNIVERSITY OF CONNECTICUT (US) 2005-02-17 WO claimed