SCHEMBL16644931

SCHEMBL16644931

C=CCOc1ccc(N(C)CC2CO2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA7 P43166 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ ALDH1A1 P00352 7/20 0.37
▸ MAPT P10636 7/20 0.37
▸ HPGD P15428 3/20 0.37
▸ TSHR P16473 3/20 0.37
▸ TP53 P04637 3/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ PPARG P37231 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ GAA P10253 3/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ USP2 O75604 1/20 0.36

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
SCHEMBL16640993 0.85 CA12 (0.40) CA12CA1CA2CA7CA9
SCHEMBL14640991 0.82 ALDH1A1 (0.55) ALDH1A1MAPTHPGDTSHRTP53
SCHEMBL12177604 0.82 ALDH1A1 (0.55) ALDH1A1MAPTHPGDTSHRTP53
SCHEMBL17354956 0.79 MEN1 (0.45) ALDH1A1MAPTHPGDTSHRTP53
SCHEMBL21013003 0.79 LMNA (0.55) CA12CA1CA2CA7CA9
SCHEMBL11658554 0.77 TDP1 (0.59) CA12CA1CA2CA7CA9
SCHEMBL12672152 0.75 LMNA (0.38) ALDH1A1MAPTHPGDTSHRTP53
SCHEMBL7157640 0.74 MEN1 (0.41) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL31042806 0.74 MAOB (0.47) CA12CA1CA2CA7CA9
SCHEMBL30216937 0.74 MAOB (0.47) CA12CA1CA2CA7CA9

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-20150105493-A1 EPOXY COMPOUND HAVING ALKOXY SILYL GROUP, COMPOSITION COMPRISING SAME, CURED PRODUCT, USE THEREOF AND METHOD FOR PREPARING EPOXY COMPOUND HAVING ALKOXY SILYL GROUP KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2015-04-16 — — US disclosed
Send feedback