SCHEMBL3547148

SCHEMBL3547148

CCCC(=O)c1ccc(C(=O)OC)c(O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.56
CA1 P00915 4/20 0.56
CA2 P00918 4/20 0.56
CA7 P43166 4/20 0.56
CA9 Q16790 4/20 0.56
CA14 Q9ULX7 4/20 0.56
PDK2 Q15119 1/20 0.56
PDK4 Q16654 1/20 0.56
GAA P10253 3/20 0.53
HSD17B3 P37058 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
HPGD P15428 6/20 0.49
ALDH1A1 P00352 4/20 0.49
HSD17B10 Q99714 4/20 0.49
TSHR P16473 3/20 0.49
ALOX15 P16050 2/20 0.49
XDH P47989 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
RECQL P46063 1/20 0.49
TP53 P04637 2/20 0.47

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
SCHEMBL28510586 0.83 ALDH1A1 (0.51) GAAHSD17B3SMN1; SMN2HPGDALDH1A1
SCHEMBL29501115 0.81 CA12 (0.71) CA12CA1CA2CA7CA9
SCHEMBL162631 0.81 CA12 (0.71) CA12CA1CA2CA7CA9
SCHEMBL10564137 0.80 CA12 (0.69) CA12CA1CA2CA7CA9
SCHEMBL4209898 0.79 CA12 (0.68) CA12CA1CA2CA7CA9
SCHEMBL5132183 0.79 HPGD (0.53) CA12CA1CA2CA7CA9
SCHEMBL1483249 0.78 CA12 (0.65) CA12CA1CA2CA7CA9
SCHEMBL5082071 0.78 SMN1; SMN2 (0.65) CA12CA1CA2CA7CA9
SCHEMBL3356728 0.78 CA12 (0.57) CA12CA1CA2CA7CA9
SCHEMBL941119 0.78 HSD17B3 (0.62) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7816542-B2 Compounds and compositions as TPO mimetics IRM LLC (BM) 2010-10-19 US disclosed
US-7816542-B2 Compounds and compositions as TPO mimetics IRM LLC (BM) 2010-10-19 US disclosed
US-7816542-B2 Compounds and compositions as TPO mimetics IRM LLC (BM) 2010-10-19 US disclosed
US-20080194668-A1 Compounds and Compositions as Tpo Mimetics IRM LLC (BM) 2008-08-14 US disclosed
US-20080194668-A1 Compounds and Compositions as Tpo Mimetics IRM LLC (BM) 2008-08-14 US disclosed
US-20080194668-A1 Compounds and Compositions as Tpo Mimetics IRM LLC (BM) 2008-08-14 US disclosed
EP-1915341-A2 COMPOUNDS AND COMPOSITIONS AS TPO MIMETICS IRM, LLC (BM) 2008-04-30 EP disclosed
WO-2007022269-A2 COMPOUNDS AND COMPOSITIONS AS TPO MIMETICS IRM LLC (BM) 2007-02-22 WO disclosed
WO-2007022269-A2 COMPOUNDS AND COMPOSITIONS AS TPO MIMETICS IRM LLC (BM) 2007-02-22 WO 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-20080194668-A1 Compounds and Compositions as Tpo Mimetics MPL, TPO, THPO CA12 4600/4885CA1 4857/4885CA2 4772/4885

“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.