SCHEMBL6018049

SCHEMBL6018049

CCCCC(CC)CC1(CC(CC)CCCC)c2cc(Cl)ccc2-c2ccc(-c3nnc(-c4ccc5c(c4)C(CC(CC)CCCC)(CC(CC)CCCC)c4cc(Cl)ccc4-5)o3)cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.37
RAB9A P51151 8/20 0.37
SMN1; SMN2 Q16637 5/20 0.37
TSHR P16473 4/20 0.37
HSD17B10 Q99714 4/20 0.37
POLB P06746 2/20 0.37
MAPT P10636 1/20 0.37
TP53 P04637 4/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 4/20 0.36
HPGD P15428 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPK1 P28482 2/20 0.34
ALOX15 P16050 2/20 0.34
GRM7 Q14831 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL3159352 0.87 NPC1 (0.38) NPC1RAB9ASMN1; SMN2TSHRHSD17B10
SCHEMBL3814580 0.86 ALDH1A1 (0.40) TSHRMAPTALDH1A1MAPK1TDP1
SCHEMBL31388556 0.86 ALDH1A1 (0.40) TSHRMAPTALDH1A1MAPK1TDP1
SCHEMBL14081253 0.83 RAB9A (0.35) NPC1RAB9ASMN1; SMN2TSHRHSD17B10
SCHEMBL6018365 0.82 ALDH1A1 (0.34) ALDH1A1MAPK1
SCHEMBL13607204 0.82 MEN1 (0.37) NPC1RAB9ATSHRHSD17B10MAPT
SCHEMBL6018281 0.79 ALDH1A1 (0.36) TSHRALDH1A1MAPK1
SCHEMBL6018079 0.76 ALDH1A1 (0.36) TSHRALDH1A1MAPK1
SCHEMBL6018141 0.76 ALDH1A1 (0.40) TSHRHSD17B10KDM4EALDH1A1MAPK1
SCHEMBL2143446 0.75 MAPT (0.35) NPC1RAB9ASMN1; SMN2TSHRHSD17B10

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-7138483-B2 Monomers, conjugated polymers and electronic devices using such polymers E.I. DU PONT DE NEMOURS AND COMPANY (US) 2006-11-21 US disclosed
US-20040192871-A1 Monomers, conjugated polymers and electronic devices using such polymers E. I. DU PONT DE NEMOURS AND COMPANY 2004-09-30 US disclosed
WO-2004072123-A2 MONOMERS, CONJUGATED POLYMERS AND ELECTRONIC DEVICES USING SUCH POLYMERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2004-08-26 WO disclosed