SCHEMBL8397200

SCHEMBL8397200

CC(=O)Oc1cc(C)c(O)c(C2(C)CCCCC2)c1

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
ACHE P22303 2/20 0.38
RARB P10826 4/20 0.38
RARG P13631 4/20 0.38
RARA P10276 3/20 0.36
ESR1 P03372 1/20 0.36
PGR P06401 1/20 0.36
CHRM2 P08172 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
AR P10275 1/20 0.36
CHRM1 P11229 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A3 Q01959 1/20 0.36

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
SCHEMBL8399068 0.85 TSHR (0.41) TSHRGLAALOX12NPSR1MEN1
SCHEMBL8400747 0.84 GLA (0.46) TSHRGLAALOX12NPSR1MEN1
SCHEMBL7933771 0.83 RARB (0.39) TSHRGLAALOX12MEN1KMT2A
SCHEMBL8401630 0.82 GLA (0.39) TSHRGLAALOX12NPSR1MEN1
SCHEMBL8401653 0.79 RARB (0.51) GLAACHERARBRARGRARA
SCHEMBL3688841 0.76 LMNA (0.50) TSHRGLAMEN1KMT2AHSD17B10
SCHEMBL39469 0.75 GLA (0.60) TSHRGLAALOX12NPSR1MEN1
SCHEMBL29373474 0.75 GLA (0.60) TSHRGLAALOX12NPSR1MEN1
SCHEMBL3810035 0.75 RARB (0.50) TSHRGLAALOX12NPSR1MEN1
SCHEMBL8400759 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 2 patents. 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
US-5889095-A OXYGEN AND HEAT RESISTANCE SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1999-03-30 US disclosed