SCHEMBL9149341

SCHEMBL9149341

CC1(Cl)C=CC(Cl)=CC1C(=O)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.35
HTT P42858 2/20 0.35
NPC1 O15118 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
HBB P68871 1/20 0.33
EP300 Q09472 1/20 0.33
EPHX1 P07099 1/20 0.33
CES2 O00748 2/20 0.33
CES1 P23141 2/20 0.33
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
MGLL Q99685 1/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
LMNA P02545 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TP53 P04637 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL9001396 0.86 HTT (0.36) SMN1; SMN2HTTNPC1L3MBTL1MAPT
SCHEMBL9579969 0.85 ALDH1A1 (0.41) SMN1; SMN2NPC1EPHX1MEN1KMT2A
SCHEMBL27422878 0.82 HTT (0.33) HTTNPC1L3MBTL1MAPTALOX15
SCHEMBL9001399 0.78 CES1 (0.34) SMN1; SMN2HTTNPC1L3MBTL1MAPT
SCHEMBL6101719 0.78 EP300 (0.33) HTTNPC1L3MBTL1MAPTALOX15
SCHEMBL27335677 0.77 CES1 (0.33) SMN1; SMN2HTTNPC1L3MBTL1MAPT
SCHEMBL9001403 0.77 CES1 (0.39) HTTL3MBTL1MAPTALOX15HBB
SCHEMBL29067489 0.75 NPC1 (0.41) SMN1; SMN2HTTNPC1L3MBTL1MAPT
SCHEMBL28386645 0.71 ALDH1A1 (0.34) HTTNPC1L3MBTL1MAPTALOX15
SCHEMBL27335678 0.71 NPC1 (0.37) SMN1; SMN2NPC1EP300MEN1KMT2A

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
EP-0629217-A4 RIGID-ROD POLYMERS. MAXDEM INC (US) 1995-03-29 EP disclosed
EP-0629217-A1 RIGID-ROD POLYMERS MAXDEM INCORPORATED (US) 1994-12-21 EP disclosed
WO-1993018076-A1 RIGID-ROD POLYMERS MAXDEM INCORPORATED (US) 1993-09-16 WO disclosed