SCHEMBL7795203

SCHEMBL7795203

C=CCOc1cc(C)c(C=O)c(C)c1.Cc1cc(O)cc(C)c1C=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 2/20 0.42
GAA P10253 5/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
SLC5A1 P13866 1/20 0.40
SLC5A2 P31639 1/20 0.40
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
MAPT P10636 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36
ERN1 O75460 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL6954127 0.92 ALDH1A1 (0.47) KAT6AGAAALDH1A1HPGDCA12
SCHEMBL29327521 0.78 GAA (0.42) KAT6AGAAALDH1A1HPGDSLC5A1
SCHEMBL516188 0.77 CYP3A4 (0.46) GAAALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL5878693 0.76 GAA (0.42) KAT6AGAAALDH1A1HPGDSLC5A1
SCHEMBL7786825 0.76 KAT6A (0.41) KAT6AGAAALDH1A1HPGDCA12
SCHEMBL16015475 0.75 SLC5A1 (0.46) GAAALDH1A1HPGDSLC5A1SLC5A2
SCHEMBL18984966 0.75 SLC5A1 (0.46) GAAALDH1A1HPGDSLC5A1SLC5A2
SCHEMBL8127465 0.75 HPGD (0.42) GAAALDH1A1HPGDSLC5A1SLC5A2
SCHEMBL8128285 0.75 CA12 (0.41) KAT6AGAAALDH1A1HPGDSLC5A1
SCHEMBL8385349 0.75 ALDH1A1 (0.48) KAT6AGAAALDH1A1HPGDSLC5A1

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-20010027194-A1 NOVEL COMPOUNDS USEFUL AS NEURO-PROTECTIVE AGENTS ELI LILLY AND COMPANY 2001-10-04 US disclosed
EP-0906755-A2 Use of phenyl oxazole or phenyl thiazole derivatives for treating neuropathic pain ELI LILLY AND COMPANY (US) 1999-04-07 EP 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-20010027194-A1 NOVEL COMPOUNDS USEFUL AS NEURO-PROTECTIVE AGENTS NLN, PRDX5, TXN2 KAT6A 4036/4885GAA 3608/4885ALDH1A1 1209/4885

“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.