SCHEMBL13855439

SCHEMBL13855439

Cc1ccc(-c2ccc(N3C(=O)C4C5C=CC(C6C(=O)N(c7ccc(Oc8ccc(C(C)(C)c9ccc(Oc%10ccc(N%11C(=O)C%12C%13C=CC(C%14C(=O)N(C)C(=O)C%13%14)C%12C%11=O)cc%10)cc9)cc8)cc7)C(=O)C56)C4C3=O)cc2C)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 2/20 0.33
TP53 P04637 1/20 0.33
ADCY2 Q08462 5/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
LMNA P02545 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL13855429 0.93 ADCY2 (0.33) TSHRCYP3A4CYP2C19NPSR1ADCY2
SCHEMBL14563391 0.90 TSHR (0.37) TSHRCYP3A4CYP2C19NPSR1ALDH1A1
SCHEMBL15746109 0.89 TP53 (0.41) ALDH1A1TP53ADCY2SMN1; SMN2LMNA
SCHEMBL14076704 0.89 TP53 (0.41) ALDH1A1TP53ADCY2SMN1; SMN2LMNA
SCHEMBL6365242 0.89 TP53 (0.41) ALDH1A1TP53ADCY2SMN1; SMN2LMNA
SCHEMBL15746110 0.86 ALDH1A1 (0.39) ALDH1A1TP53ADCY2SMN1; SMN2LMNA
SCHEMBL13400447 0.85 TSHR (0.45) TSHRCYP3A4CYP2C19NPSR1ALDH1A1
SCHEMBL13773285 0.82 TP53 (0.42) ALDH1A1TP53ADCY2SMN1; SMN2LMNA
SCHEMBL14005780 0.81 SMN1; SMN2 (0.37) ALDH1A1TP53ADCY2SMN1; SMN2LMNA
SCHEMBL13400450 0.81 TP53 (0.48) ALDH1A1TP53ADCY2SMN1; SMN2LMNA

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-20090136689-A1 LIQUID CRYSTAL DISPLAY DEVICE LEU CHYI-MING 2009-05-28 US disclosed
US-20070065603-A1 Liquid crystal display device INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE 2007-03-22 US disclosed