SCHEMBL8840907

SCHEMBL8840907

C=CCSc1cc2c3cc(SCC=C)c(SCC=C)cc3c3cc(SCC=C)c(SCC=C)cc3c2cc1SCC=C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.36
HPGD P15428 5/20 0.36
TRPA1 O75762 2/20 0.36
CYP3A4 P08684 2/20 0.36
ALOX15 P16050 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALOX5 P09917 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 4/20 0.34
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RECQL P46063 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
NPC1 O15118 1/20 0.30
TP53 P04637 1/20 0.30
NFKB1 P19838 1/20 0.30
RAB9A P51151 1/20 0.30
NFKB2 Q00653 1/20 0.30

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
SCHEMBL8770615 0.89 ALDH1A1 (0.40) ALDH1A1HPGDTRPA1CYP3A4ALOX15
SCHEMBL10910595 0.81 USP2 (0.40) NPSR1L3MBTL1MEN1KMT2AMAPT
SCHEMBL10908824 0.81 USP2 (0.40) NPSR1L3MBTL1MEN1KMT2AMAPT
SCHEMBL7249041 0.75 ALDH1A1 (0.33) ALDH1A1HPGDTRPA1CYP3A4ALOX15
SCHEMBL8832217 0.75 NPSR1 (0.32) ALDH1A1NPSR1L3MBTL1MAPT
SCHEMBL10351891 0.74 MEN1 (0.48) ALDH1A1HPGDTRPA1CYP3A4ALOX15
SCHEMBL8521655 0.72 ALDH1A1 (0.40) ALDH1A1HPGDTRPA1CYP3A4ALOX15
SCHEMBL7248618 0.72 L3MBTL1 (0.37) ALDH1A1HPGDTRPA1CYP3A4ALOX15
SCHEMBL21571788 0.72 L3MBTL1 (0.31) ALDH1A1HPGDTRPA1CYP3A4ALOX15
SCHEMBL10584677 0.70 TP53 (0.33) L3MBTL1MEN1KMT2AMAPTTP53

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
US-5637669-A THERMOSETTING RESIN; LIQUID CRYSTALLINE POLYMERS THE DOW CHEMICAL COMPANY (US) 1997-06-10 US disclosed
EP-0670856-A1 THERMOSETTABLE COMPOSITION CONTAINING MESOGENIC MOIETIES THE DOW CHEMICAL COMPANY (US) 1995-09-13 EP disclosed
WO-1994012556-A2 THERMOSETTABLE COMPOSITION CONTAINING DISCOTIC MESOGENIC MOIETIES THE DOW CHEMICAL COMPANY (US) 1994-06-09 WO disclosed