SCHEMBL9355693

SCHEMBL9355693

COc1ccc(P(=O)(O)O)c(OC)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
ALDH1A1 P00352 6/20 0.47
NPC1 O15118 3/20 0.46
CYP1A1 P04798 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP1B1 Q16678 2/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 4/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
HPGD P15428 2/20 0.44
RAD52 P43351 1/20 0.44
RAB9A P51151 2/20 0.43
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL11653462 0.87 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL10722515 0.85 CA12 (0.48) CA12CA1CA2CA7CA9
SCHEMBL11652776 0.82 CA12 (0.46) CA12CA1CA2CA7CA9
SCHEMBL11218004 0.81 CA12 (0.52) CA12CA1CA2CA7CA9
SCHEMBL10721578 0.81 CA12 (0.52) CA12CA1CA2CA7CA9
SCHEMBL17652953 0.79 ALDH1A1 (0.51) ALDH1A1NPC1MAPTRAB9AHTT
SCHEMBL16970568 0.79 INPPL1 (0.39) CA12CA1CA2CA7CA9
SCHEMBL10722001 0.77 ACP3 (0.40) CA12CA1CA2CA7CA9
SCHEMBL8518374 0.77 ERN1 (0.59) ALDH1A1CYP1A2MAPTMEN1KMT2A
SCHEMBL10798487 0.76 ALDH1A1 (0.48) CA1CA2ALDH1A1NPC1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0439470-B1 PROCESS FOR INCREASING THE MOLECULAR WEIGHT OF A POLYAMIDE DU PONT (US) 1994-11-02 EP claimed
US-4966949-A PHENYLPHOSPHINIC ACID DERIVATIVES; HIGH STRENGTH MATERIAL E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-10-30 US claimed
EP-0439470-B1 PROCESS FOR INCREASING THE MOLECULAR WEIGHT OF A POLYAMIDE DU PONT (US) 1994-11-02 EP disclosed
EP-0439470-A1 PROCESS FOR INCREASING THE MOLECULAR WEIGHT OF A POLYAMIDE. DU PONT (US) 1991-08-07 EP disclosed
US-4966949-A PHENYLPHOSPHINIC ACID DERIVATIVES; HIGH STRENGTH MATERIAL E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-10-30 US disclosed
WO-1990004614-A1 PROCESS FOR INCREASING THE MOLECULAR WEIGHT OF A POLYAMIDE E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-05-03 WO disclosed