SCHEMBL14960346

SCHEMBL14960346

CCC(C)C(CC)c1ccc(O)c(OC)c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.57
CYP3A4 P08684 1/20 0.57
NFKB1 P19838 1/20 0.55
FOS P01100 1/20 0.54
TTR P02766 1/20 0.54
JUN P05412 1/20 0.54
NR3C1 P04150 1/20 0.54
HSD17B1 P14061 1/20 0.54
HSD17B2 P37059 1/20 0.54
BLM P54132 2/20 0.54
PMP22 Q01453 1/20 0.54
BCHE P06276 2/20 0.54
TYR P14679 2/20 0.54
ACHE P22303 2/20 0.54
SLC22A3 O75751 1/20 0.54
NPSR1 Q6W5P4 1/20 0.51
ALOX15 P16050 1/20 0.50
ALOX12 P18054 1/20 0.50
LMNA P02545 1/20 0.49

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
SCHEMBL21402272 0.85 TSHR (0.55) TSHRCYP3A4NFKB1FOSTTR
SCHEMBL13561450 0.85 TSHR (0.58) TSHRCYP3A4NFKB1FOSTTR
SCHEMBL14960322 0.85 TSHR (0.58) TSHRCYP3A4NFKB1FOSTTR
SCHEMBL12512568 0.83 TSHR (0.61) TSHRCYP3A4NFKB1FOSTTR
SCHEMBL21402286 0.82 TSHR (0.55) TSHRCYP3A4NFKB1FOSTTR
SCHEMBL178482 0.81 TSHR (0.62) TSHRCYP3A4NFKB1FOSTTR
SCHEMBL17179842 0.80 TSHR (0.63) TSHRCYP3A4NFKB1FOSTTR
SCHEMBL5072122 0.79 BCHE (0.73) TSHRCYP3A4NFKB1FOSTTR
SCHEMBL30491037 0.79 BCHE (0.73) TSHRCYP3A4NFKB1FOSTTR
SCHEMBL20000881 0.79 TSHR (0.55) TSHRCYP3A4NFKB1FOSTTR

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
US-8445565-B2 Flame retardant agents and flame retardant materials comprising the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2013-05-21 US disclosed