SCHEMBL7982330

SCHEMBL7982330

OCc1ccc(I)cc1OCc1ccc(-c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APP P05067 6/20 0.48
GSTP1 P09211 1/20 0.44
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
ELANE P08246 3/20 0.41
F2 P00734 1/20 0.41
SMPD1 P17405 1/20 0.41
FFAR1 O14842 2/20 0.40
IDO1 P14902 2/20 0.40
AGXT P21549 2/20 0.40
CARM1 Q86X55 1/20 0.40
PRMT1 Q99873 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL2853160 0.91 APP (0.49) APPELANEF2FFAR1
SCHEMBL2985019 0.82 CARM1 (0.55) GSTP1RXRARXRBRXRGFFAR1
SCHEMBL7983941 0.80 MAOB (0.47) GSTP1
SCHEMBL1023923 0.79 ELANE (0.53) APPELANEF2FFAR1
SCHEMBL18906416 0.79 ELANE (0.49) ELANEF2
SCHEMBL11847148 0.77 APP (0.47) APPFFAR1
SCHEMBL3739211 0.77 CYP11B1 (0.41) IDO1
SCHEMBL4698492 0.76 TSHR (0.48) ELANEF2
SCHEMBL7907404 0.74 ALOX5 (0.54) GSTP1ELANEF2
SCHEMBL7984303 0.74 FFAR1 (0.46) APPGSTP1RXRARXRBRXRG

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-6297239-B1 Inhibitors of prenyl-protein transferase MERCK & CO., INC. 2001-10-02 US disclosed