SCHEMBL6903704

SCHEMBL6903704

Cc1cc(C)c(Cc2cc(C(C)(C)C)cc3c2Cc2c(cc(C(C)(C)C)cc2Cc2c(C)cc(C)cc2C)CC3)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 8/20 0.38
HTR1B P28222 6/20 0.38
ADRA2A P08913 3/20 0.38
ADRA2B P18089 3/20 0.38
ADRA2C P18825 3/20 0.38
HTR1A P08908 2/20 0.38
LMNA P02545 2/20 0.38
ADRA1D P25100 2/20 0.38
ADRA1A P35348 2/20 0.38
ADRA1B P35368 2/20 0.38
CYP2D6 P10635 2/20 0.38
TP53 P04637 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
DRD2 P14416 1/20 0.38
TSHR P16473 1/20 0.38
CHRM3 P20309 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL6907139 0.80 TAAR1 (0.35) HTR1DHTR1BADRA2AADRA2BADRA2C
SCHEMBL6906006 0.75 POLB (0.41) HTR1DHTR1BADRA2AADRA2BADRA2C
SCHEMBL6905892 0.74 PON1 (0.36) CYP2D6ELANECD69CYP1A2CYP2C9
SCHEMBL6900216 0.65 POLB (0.35) HTR1DHTR1BADRA2AADRA2BADRA2C
SCHEMBL6901135 0.64 POLB (0.41) HTR1DHTR1BADRA2AADRA2BADRA2C
SCHEMBL6906560 0.63 ELANE (0.37) HTR1DHTR1BCYP2D6TSHRHTR2A
SCHEMBL1655430 0.62 GABRA1 (0.55) HTR1DHTR1BADRA2AADRA2BADRA2C
SCHEMBL1316919 0.62 HTR1D (0.48) HTR1DHTR1BLMNATP53TSHR
SCHEMBL316288 0.62 TSHR (0.50) HTR1DHTR1BADRA2AADRA2BADRA2C
SCHEMBL21518797 0.62 CYP1A2 (0.36) CYP2D6TSHRMAPK1CYP3A4MAPT

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-6815481-B2 FUSED DIBENZO THERMAL STABILIZERS SUCH AS ANTHRACENE, XANTHENE AND ANTHRONE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-09 US disclosed
US-20020032256-A1 Polybutadiene composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-03-14 US disclosed