SCHEMBL5534766

SCHEMBL5534766

CCC(C)c1ccc(C[PH](c2c(CO)cc(OC)cc2CO)(c2c(CO)cc(OC)cc2OC)c2c(OC)cc(CO)cc2OC)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.38
▸ MAPT P10636 4/20 0.38
▸ GAA P10253 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ HPGD P15428 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ NPC1 O15118 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ ADRB2 P07550 2/20 0.32
▸ ABCB11 O95342 1/20 0.32
▸ TSHR P16473 1/20 0.31
▸ CALM1 P0DP23 1/20 0.31

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
SCHEMBL18876835 0.83 PTPN1 (0.44) ALDH1A1MAPTGAAALOX12HPGD
SCHEMBL5528935 0.80 PDE4A (0.36) MAPTTSHRCALM1PTPN1
SCHEMBL18876836 0.77 PTPN1 (0.39) ALDH1A1MAPTGAATP53HPGD
SCHEMBL2758520 0.68 ALDH1A1 (0.41) ALDH1A1MAPTGAALMNATP53
SCHEMBL11436456 0.67 ALDH1A1 (0.49) ALDH1A1MAPTGAALMNATP53
SCHEMBL18863400 0.66 PTPN1 (0.50) ALDH1A1MEN1KMT2AL3MBTL1TSHR
SCHEMBL357876 0.65 ESR1 (0.47) ALDH1A1MAPTGAAHPGDNPC1
SCHEMBL14094634 0.65 ESR1 (0.47) ALDH1A1MAPTGAAHPGDNPC1
SCHEMBL22838628 0.64 TTR (0.42) ALOX12POLBNPC1RAB9ATSHR
SCHEMBL20147805 0.64 FNTA (0.34) MAPTCALM1PTPN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8535586-B2 Highly basic ionomers and membranes and anion/hydroxide exchange fuel cells comprising the ionomers and membranes THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-09-17 — — US disclosed
US-20120119410-A1 HIGHLY BASIC IONOMERS AND MEMBRANES AND ANION/HYDROXIDE EXCHANGE FUEL CELLS COMPRISING THE IONOMERS AND MEMBRANES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-05-17 — — US disclosed
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