SCHEMBL4383362

SCHEMBL4383362

CN(C)c1ccc(CC2CCCC(Cc3ccc(N(C)C)cc3)C2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 1/20 0.49
ALDH1A1 P00352 4/20 0.48
TSHR P16473 2/20 0.48
CYP3A4 P08684 1/20 0.48
MAPK1 P28482 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
KDM4E B2RXH2 2/20 0.42
MAPT P10636 2/20 0.42
GAA P10253 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HRH3 Q9Y5N1 2/20 0.41
G6PD P11413 1/20 0.39
CCR6 P51684 1/20 0.39
HKDC1 Q2TB90 1/20 0.39
PTGS1 P23219 2/20 0.38
PTGS2 P35354 2/20 0.38
OPRK1 P41145 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL11794212 0.88 ALDH1A1 (0.46) CYP26A1ALDH1A1TSHRCYP3A4MAPK1
SCHEMBL5593665 0.83 PTGS1 (0.52) CYP26A1ALDH1A1TSHRCYP3A4MAPK1
SCHEMBL9567330 0.83 ALDH1A1 (0.50) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL11791462 0.82 CYP26A1 (0.47) CYP26A1ALDH1A1KDM4EMAPTGAA
SCHEMBL11794375 0.82 PTGS1 (0.51) CYP26A1ALDH1A1TSHRCYP3A4MAPK1
SCHEMBL19050082 0.80 L3MBTL1 (0.44) ALDH1A1MAPK1GAAL3MBTL1PTGS1
SCHEMBL11473643 0.80 L3MBTL1 (0.44) ALDH1A1MAPK1GAAL3MBTL1PTGS1
SCHEMBL11795851 0.77 ALDH1A1 (0.40) CYP26A1ALDH1A1KDM4EMAPTGAA
SCHEMBL14489571 0.76 ALDH1A1 (0.53) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL19050136 0.76 POLB (0.47) CYP26A1TSHRKMT2A

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-8414801-B2 Conductive polymer solution, antistatic coating material, antistatic hard coat layer, optical filter, conductive coating film, antistatic tacky adhesive, antistatic tacky adhesive layer, protective material, and method for producing the same SHIN-ETSU POLYMER CO., LTD. (JP) 2013-04-09 US disclosed
US-20090294735-A1 CONDUCTIVE POLYMER SOLUTION, ANTISTATIC COATING MATERIAL, ANTISTATIC HARD COAT LAYER, OPTICAL FILTER, CONDUCTIVE COATING FILM, ANTISTATIC TACKY ADHESIVE LAYER, PROTECTIVE MATERIAL, AND METHOD FOR PRODUCING THE SAME SHIN-ETSU POLYMER CO., LTD. (JP) 2009-12-03 US disclosed