SCHEMBL7056082

SCHEMBL7056082

Cc1cccc2c1Cc1c(C)cccc1CC2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.41
BAD Q92934 1/20 0.41
PARP1 P09874 1/20 0.38
PARP10 Q53GL7 1/20 0.38
PARP11 Q9NR21 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
ACHE P22303 2/20 0.36
ADRA2A P08913 1/20 0.36
CYP2D6 P10635 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
TSHR P16473 1/20 0.36
DRD2 P14416 1/20 0.36
DRD1 P21728 1/20 0.36
DRD5 P21918 1/20 0.36
DRD3 P35462 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
SCHEMBL6905197 0.89 DRD3 (0.49) BCL2L1BADPARP1PARP10PARP11
SCHEMBL11352084 0.87
SCHEMBL8368154 0.85 CYP2A6 (0.52) BCL2L1BADPARP1PARP10PARP11
SCHEMBL413550 0.80 BCL2L1 (0.52) BCL2L1BADPARP1PARP10PARP11
SCHEMBL6904839 0.80 PARP1 (0.38) BCL2L1BADPARP1PARP10PARP11
SCHEMBL30717272 0.80 BCL2L1 (0.58) BCL2L1BADTSHRALDH1A1SMN1; SMN2
SCHEMBL598625 0.80 BCL2L1 (0.58) BCL2L1BADTSHRALDH1A1SMN1; SMN2
SCHEMBL29892288 0.80 BCL2L1 (0.52) BCL2L1BADPARP1PARP10PARP11
SCHEMBL5598514 0.78 BCL2L1 (0.56) BCL2L1BADACHETSHRALDH1A1
SCHEMBL1192279 0.78 DRD2 (0.41) CYP1A2CYP2A6ACHETSHRDRD2

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