SCHEMBL6908304

SCHEMBL6908304

C=CC(=O)OC1(CC)CCCCCCCCCCC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.36
HPGD P15428 1/20 0.36
ALDH1A1 P00352 4/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
CYP3A4 P08684 1/20 0.31
HSD17B10 Q99714 1/20 0.31
THRB P10828 2/20 0.31
KDM4E B2RXH2 3/20 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
SCHEMBL525794 1.00 TSHR (0.36) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL685575 1.00 TSHR (0.36) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL685579 1.00 TSHR (0.36) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL680647 0.98 TSHR (0.37) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL674234 0.90 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL10887530 0.87 THRB (0.33) TSHRALDH1A1THRB
SCHEMBL1397188 0.86 TSHR (0.38) TSHRHPGDTHRB
SCHEMBL5154743 0.86 TSHR (0.38) TSHRHPGDTHRB
SCHEMBL22772601 0.85 TSHR (0.33) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL1524440 0.85 CTSL (0.33) KDM4E

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004041770-A1 CHEMICALLY AMPLIFIED POLYMER HAVING PENDANT GROUP WITH CYCLODODECYL AND RESIST COMPOSITION COMPRISING THE SAME DONGJIN SEMICHEM CO., LTD. (KR) 2004-05-21 WO disclosed