SCHEMBL9145010

SCHEMBL9145010

C=CCCCCCCOc1ccc(-c2ccc(C(=O)Cl)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.60
ALDH1A1 P00352 1/20 0.60
RARB P10826 4/20 0.50
HTT P42858 1/20 0.50
GAA P10253 1/20 0.47
HDAC3 O15379 2/20 0.46
HDAC4 P56524 2/20 0.46
HDAC1 Q13547 2/20 0.46
HDAC7 Q8WUI4 2/20 0.46
HDAC2 Q92769 2/20 0.46
HDAC10 Q969S8 2/20 0.46
HDAC11 Q96DB2 2/20 0.46
HDAC8 Q9BY41 2/20 0.46
HDAC6 Q9UBN7 2/20 0.46
HDAC9 Q9UKV0 2/20 0.46
HDAC5 Q9UQL6 2/20 0.46
LSS P48449 6/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
PLA2G4B P0C869 1/20 0.42

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
SCHEMBL10261955 0.96 L3MBTL1 (0.65) L3MBTL1ALDH1A1HTTGAALSS
SCHEMBL8379458 0.96 L3MBTL1 (0.65) L3MBTL1ALDH1A1HTTGAALSS
SCHEMBL8152256 0.94 L3MBTL1 (0.67) L3MBTL1ALDH1A1HTTGAALSS
SCHEMBL5407527 0.90 L3MBTL1 (0.73) L3MBTL1ALDH1A1HTTGAALSS
SCHEMBL8606864 0.87 ALDH1A1 (0.80) L3MBTL1ALDH1A1RARBHTTTP53
SCHEMBL10700779 0.87 ALDH1A1 (0.80) L3MBTL1ALDH1A1RARBHTTTP53
SCHEMBL9146800 0.87 ALDH1A1 (0.80) L3MBTL1ALDH1A1RARBHTTTP53
SCHEMBL8377630 0.87 ALDH1A1 (0.80) L3MBTL1ALDH1A1RARBHTTTP53
SCHEMBL8175158 0.85 ALDH1A1 (0.82) L3MBTL1ALDH1A1RARBHTTHDAC3
SCHEMBL3229845 0.85 L3MBTL1 (0.61) L3MBTL1ALDH1A1HTTGAALSS

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-5451339-A Liquid crystal monomeric compound and liquid crystal polymer compound modified therewith SHOWA SHELL SEKIYU KABUSHIKI KAISHA (JP) 1995-09-19 US disclosed
EP-0571276-A1 Liquid crystal monomeric compound and liquid crystal polymer compound modified therewith Showa Shell Sekiyu Kabushiki Kaisha (JP) 1993-11-24 EP disclosed