SCHEMBL6902800

SCHEMBL6902800

CC(C)c1cccc2c1Cc1c(cccc1C(C)C)O2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
GABRB2 P47870 2/20 0.41
LMNA P02545 2/20 0.41
FAAH O00519 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
GABRB1 P18505 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2C P28335 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
HTR2B P41595 1/20 0.41
GABRA2 P47869 1/20 0.41

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
SCHEMBL28629769 0.87 MAOA (0.53) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL24390046 0.74 GABRA1 (0.44) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL15287965 0.73 MAOA (0.50) LMNAMAOAMAOBP2RX4SMN1; SMN2
SCHEMBL25481540 0.72 GABRA1 (0.39) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL9910076 0.72 HTR2C (0.39) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL8842384 0.71 MAOA (0.41) CA1CA2CYP1A2TSHRHTR2C
SCHEMBL5503549 0.71 GABRA1 (0.46) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL29801762 0.71 GABRA1 (0.46) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL26360580 0.71 AHR (0.50) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL18929986 0.69 GABRA1 (0.36) GABRA1GABRG2GABRB3GABRB2LMNA

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