SCHEMBL6906560

SCHEMBL6906560

CC(C)(C)c1cc(Cc2ccccc2)c2c(c1)Cc1cc(C(C)(C)C)cc(Cc3ccccc3)c1CC2

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.37
CD69 Q07108 1/20 0.37
BCL2 P10415 1/20 0.36
BCL2L1 Q07817 1/20 0.36
ALOX5 P09917 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35
HTR2C P28335 3/20 0.35
TACR1 P25103 2/20 0.35
CYP2D6 P10635 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2B P41595 1/20 0.33
CALM1 P0DP23 1/20 0.32
EGFR P00533 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL6906312 0.93 CYP2D6 (0.35) ELANECD69BCL2BCL2L1ALOX5
SCHEMBL29025750 0.74 BCL2 (0.42) BCL2BCL2L1ALOX5HPGDTSHR
SCHEMBL10871265 0.74 BCL2 (0.52) BCL2BCL2L1ALOX5CYP2D6
SCHEMBL11212329 0.72 BCL2 (0.50) BCL2BCL2L1ALOX5CYP2D6
SCHEMBL6905933 0.72 HTR2A (0.41) BCL2BCL2L1ALOX5HPGDHTR2C
SCHEMBL6903718 0.72 PON1 (0.37) ELANECD69CYP2D6
SCHEMBL10539899 0.69 CYP2D6 (0.44) BCL2BCL2L1HPGDTSHRHTR1D
SCHEMBL27273119 0.69 CALM1 (0.52) BCL2BCL2L1HPGDTSHRHTR1D
SCHEMBL6901135 0.69 POLB (0.41) ELANECD69TSHRHTR1DHTR1B
SCHEMBL7110304 0.69 CYP2C9 (0.52) BCL2BCL2L1TSHRCYP2D6ALDH1A1

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