SCHEMBL8400760

SCHEMBL8400760

CCc1cc(C(C)C(=O)O)cc(C2(C)CCCCC2)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
GLA P06280 1/20 0.44
ALOX12 P18054 1/20 0.44
NPSR1 Q6W5P4 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.36
AKR1C3 P42330 4/20 0.36
AKR1C2 P52895 3/20 0.36
RARB P10826 4/20 0.36
RARG P13631 3/20 0.36
PTGDR Q13258 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
RARA P10276 2/20 0.34
PTGS2 P35354 6/20 0.34
AKR1B1 P15121 1/20 0.33
PTGS1 P23219 4/20 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
SCHEMBL8399246 0.85 GLA (0.47) TSHRGLAALOX12NPSR1MEN1
SCHEMBL8399071 0.84 GLA (0.40) TSHRGLAALOX12NPSR1MEN1
SCHEMBL8400766 0.84 PTGDR (0.36) TSHRGLAALOX12TP53AKR1C3
SCHEMBL8595049 0.83 GLA (0.43) TSHRGLAALOX12NPSR1MEN1
SCHEMBL8400772 0.81 GLA (0.46) TSHRGLAALOX12NPSR1MEN1
SCHEMBL8401328 0.81 GLRA3 (0.36) TSHRGLAALOX12NPSR1MEN1
SCHEMBL7786437 0.78 RARB (0.48) TSHRGLAALOX12NPSR1MEN1
SCHEMBL8401697 0.78 RARB (0.50) TSHRMEN1KMT2AAKR1C3AKR1C2
SCHEMBL7940089 0.76 TSHR (0.46) TSHRGLAALOX12NPSR1MEN1
SCHEMBL7941331 0.74 GLA (0.44) TSHRGLAALOX12NPSR1MEN1

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-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed