SCHEMBL6905933

SCHEMBL6905933

c1ccc(Cc2cccc3c2CCc2c(Cc4ccccc4)cccc2C3)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 4/20 0.41
CALM1 P0DP23 1/20 0.41
HTR2C P28335 2/20 0.40
HTR2B P41595 2/20 0.40
BCL2 P10415 1/20 0.39
BCL2L1 Q07817 1/20 0.39
PNMT P11086 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALOX5 P09917 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HRH1 P35367 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
DRD1 P21728 1/20 0.34
DRD4 P21917 1/20 0.34

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
SCHEMBL6906810 0.95 HTR2A (0.38) HTR2ACALM1HTR2CHTR2BBCL2
SCHEMBL5677912 0.83 BCL2L1 (0.46) HTR2ACALM1HTR2CHTR2BBCL2L1
SCHEMBL11947277 0.79 HTR2C (0.48) HTR2AHTR2CHTR2BHRH1
SCHEMBL8151881 0.78 PNMT (0.64) HTR2ACALM1HTR2BBCL2BCL2L1
SCHEMBL8917078 0.74 DRD2 (0.46) HTR2ACALM1HTR2BBCL2BCL2L1
SCHEMBL30882161 0.74 KDM4E (0.41) HTR2AHTR2CHTR2BPNMTCYP1A2
SCHEMBL7176180 0.74 CYP11B1 (0.41) HTR2ACALM1HTR2CHTR2BBCL2
SCHEMBL11631564 0.73 ALDH1A1 (0.47) HTR2ACALM1HTR2CHTR2BCYP1A2
SCHEMBL23527423 0.73 MAOA (0.52) PNMTCYP1A2CYP2C9CYP2C19HPGD
SCHEMBL1724852 0.72 TRPV1 (0.53) HTR2AHTR2CHTR2B

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