SCHEMBL6008353

SCHEMBL6008353

COc1cccc2[nH]c3cccc(OC)c3c12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.65
HTR2C P28335 3/20 0.51
MEN1 O00255 2/20 0.51
HPGD P15428 2/20 0.51
KMT2A Q03164 2/20 0.51
GABRP O00591 1/20 0.51
GABRD O14764 1/20 0.51
GABRA1 P14867 1/20 0.51
GABRB1 P18505 1/20 0.51
GABRG2 P18507 1/20 0.51
GABRB3 P28472 1/20 0.51
GABRA5 P31644 1/20 0.51
GABRA3 P34903 1/20 0.51
GABRA2 P47869 1/20 0.51
GABRB2 P47870 1/20 0.51
GABRA4 P48169 1/20 0.51
GABRE P78334 1/20 0.51
GABRA6 Q16445 1/20 0.51
GABRG1 Q8N1C3 1/20 0.51
GABRG3 Q99928 1/20 0.51

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
SCHEMBL6007703 0.90 ABCG2 (0.56) ABCG2HTR2CMEN1HPGDKMT2A
SCHEMBL29707164 0.87 ABCG2 (0.53) ABCG2HTR2CMEN1HPGDKMT2A
SCHEMBL3362359 0.86 ABCG2 (0.75) ABCG2HTR2CMEN1HPGDKMT2A
SCHEMBL31216295 0.86 ABCG2 (0.75) ABCG2HTR2CMEN1HPGDKMT2A
SCHEMBL8762464 0.81 KDM4E (0.56) ABCG2HTR2CMEN1HPGDKMT2A
SCHEMBL6688990 0.81 ALDH1A1 (0.52) ABCG2HPGDKDM4EALDH1A1MAPT
SCHEMBL5733923 0.80 ABCG2 (0.50) ABCG2HTR2CMEN1HPGDKMT2A
SCHEMBL9352467 0.80 ABCG2 (1.00) ABCG2MEN1HPGDKMT2AGABRP
SCHEMBL5879154 0.78 ABCG2 (0.53) ABCG2HTR2CMEN1HPGDKMT2A
SCHEMBL28645747 0.78 ABCG2 (0.53) ABCG2MEN1HPGDKMT2AGABRP

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-20060183022-A1 Electrochemical cell NEC TOKIN CORORATION (JP) 2006-08-17 US disclosed