SCHEMBL10072034

SCHEMBL10072034

O=CCP(=O)(CC=O)Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.57
ADH1B P00325 1/20 0.39
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
ADH7 P40394 1/20 0.39
EPHX2 P34913 1/20 0.38
TSHR P16473 1/20 0.36
MAOB P27338 1/20 0.36
FDPS P14324 1/20 0.35
EPHX1 P07099 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CALM1 P0DP23 1/20 0.35
LAP3 P28838 2/20 0.34
ANPEP P15144 1/20 0.34

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
SCHEMBL388208 0.81 HPGD (0.73) HPGDEPHX2TSHRFDPSCYP3A4
SCHEMBL8955117 0.81 HPGD (0.55) HPGDEPHX2TSHRMAOBFDPS
SCHEMBL12316600 0.79 TAAR1 (0.35) HPGDMAOBMEN1KMT2A
SCHEMBL9417268 0.77 HPGD (0.67) HPGDEPHX2TSHRFDPSCYP3A4
SCHEMBL12316601 0.75 TSPO (0.37) HPGDCYP3A4CYP2C19MEN1KMT2A
SCHEMBL9417317 0.73 HPGD (0.61) HPGDEPHX2TSHRMEN1KMT2A
SCHEMBL5210171 0.73 HPGD (0.61) HPGDEPHX2TSHRMEN1KMT2A
SCHEMBL9417285 0.73 HPGD (0.61) HPGDEPHX2TSHR
SCHEMBL18486627 0.73 HPGD (0.61) HPGDEPHX2CALM1
SCHEMBL9417506 0.71 HPGD (0.59) HPGDEPHX2TSHR

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-20120043533-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-02-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120043533-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING THE SAME AOC2, AOC3, H1-4 HPGD 3491/4885ADH1B 2138/4885ADH1C 1750/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.