SCHEMBL1619453

SCHEMBL1619453

O=C(O)COc1[c]c(OCC(=O)O)cc(C(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.41
▸ KMT2A Q03164 2/20 0.40
▸ PLAU P00749 1/20 0.40
▸ CD69 Q07108 3/20 0.39
▸ MCL1 Q07820 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ PTPN7 P35236 1/20 0.38
▸ ELANE P08246 1/20 0.38
▸ PTGDR2 Q9Y5Y4 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA7 P43166 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ CA14 Q9ULX7 1/20 0.37

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
SCHEMBL1937755 0.75 KMT2A (0.57) ALOX15KMT2ACD69KDM4EPTPN7
SCHEMBL6045418 0.75 ALOX15 (0.54) ALOX15KMT2ACD69MCL1PTPN7
SCHEMBL11576418 0.74 PLAU (0.64) ALOX15KMT2APLAUMCL1KDM4E
SCHEMBL13367355 0.69 PTGS2 (0.59) KMT2AKDM4ETDP1MEN1LMNA
SCHEMBL341847 0.67 ALOX15 (0.65) ALOX15KMT2APTPN7MEN1
SCHEMBL2777170 0.66 CA12 (0.52) ALOX15PLAUKDM4ETDP1LMNA
SCHEMBL28645298 0.66 ALOX15 (0.65) ALOX15KMT2ACD69MCL1PTPN7
SCHEMBL10167730 0.65 NR4A2 (0.65) ALOX15KMT2APTPN7LMNA
SCHEMBL6566253 0.64 PTPN7 (0.69) ALOX15KMT2AMCL1KDM4EPTPN7
SCHEMBL8908528 0.64 FOLH1 (0.37) ALOX15KMT2AKDM4ETDP1MEN1

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-7928222-B2 Porphyrin compound, process for producing porphyrin compound, three-dimensional optical recording material, and three-dimensional optical recording medium National University Corporation NARA Institute of Science and Technology (JP) 2011-04-19 — — US disclosed
US-20070224529-A1 Porphyrin compound, process for producing porphyrin compound, three-dimensional optical recording material, and three-dimensional optical recording medium National University Corporation NARA Institute of Science and Technology (JP) 2007-09-27 — — 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-20070224529-A1 Porphyrin compound, process for producing porphyrin compound, three-dimensional optical recording material, and three-dimensional optical recording medium PPOX, PNMT, PAH ALOX15 1085/4885KMT2A 1471/4885PLAU 2766/4885

“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.

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