SCHEMBL6903663

SCHEMBL6903663

COc1ccc2c(c1)Cc1cc(OC)ccc1C2

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 8/20 0.68
DRD2 P14416 8/20 0.68
DRD3 P35462 8/20 0.68
DRD5 P21918 7/20 0.68
DRD4 P21917 5/20 0.59
METAP1 P53582 2/20 0.55
CYP3A4 P08684 1/20 0.50
MAPT P10636 1/20 0.50
CYP19A1 P11511 1/20 0.50
BCL2 P10415 1/20 0.50
CHRNA7 P36544 1/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48

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
SCHEMBL12595448 1.00
SCHEMBL6907774 1.00 DRD1 (0.68) DRD1DRD2DRD3DRD5DRD4
Ammonia Solution, Strong SCHEMBL1799116 0.98 DRD1 (0.66) DRD1DRD2DRD3DRD5DRD4
SCHEMBL6900363 0.93 DRD1 (0.74) DRD1DRD2DRD3DRD5DRD4
SCHEMBL4581239 0.88 METAP1 (0.63) DRD1DRD2DRD3DRD5DRD4
SCHEMBL30777630 0.88 METAP1 (0.63) DRD1DRD2DRD3DRD5DRD4
SCHEMBL22523888 0.87 DRD2 (0.55) DRD1DRD2DRD3DRD5DRD4
SCHEMBL4041676 0.87 METAP1 (0.58) DRD1DRD2DRD3DRD5DRD4
SCHEMBL4895916 0.83 METAP1 (0.61) DRD1DRD2DRD3DRD5DRD4
SCHEMBL23835146 0.82 METAP1 (0.73) DRD1DRD2DRD3DRD5METAP1

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-6815481-B2 FUSED DIBENZO THERMAL STABILIZERS SUCH AS ANTHRACENE, XANTHENE AND ANTHRONE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-09 US disclosed