SCHEMBL2949569

SCHEMBL2949569

COC(=O)C(O)Oc1ccccc1C

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.43
KMT2A Q03164 1/20 0.43
NOTUM Q6P988 2/20 0.43
TDP1 Q9NUW8 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ATM Q13315 1/20 0.42
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40

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
SCHEMBL20097882 0.82 HPGD (0.56) HPGDTSHRKMT2ANOTUMTDP1
SCHEMBL21415510 0.82 HPGD (0.56) HPGDTSHRKMT2ANOTUMTDP1
SCHEMBL29249525 0.81 HPGD (0.44) HPGDTSHRKMT2ANOTUMTDP1
SCHEMBL29163286 0.78 KMT2A (0.51) HPGDTSHRKMT2AL3MBTL1CYP1A2
SCHEMBL8477888 0.78 ALDH1A1 (0.51) HPGDTSHRKMT2ATDP1L3MBTL1
SCHEMBL9205126 0.77 HPGD (0.42) HPGDTSHRKMT2ANOTUMTDP1
SCHEMBL15397124 0.74 TDP1 (0.43) HPGDTSHRKMT2ANOTUMTDP1
SCHEMBL29097030 0.73 CASP1 (0.41) HPGDTSHRNOTUMALDH1A1
SCHEMBL1598495 0.73 HPGD (0.61) HPGDKMT2ANOTUMTDP1L3MBTL1
SCHEMBL515976 0.72 CYP1A2 (0.48) HPGDTSHRKMT2ANOTUMTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7750032-B2 Compounds and compositions as PPAR modulators IRM LLC (BM) 2010-07-06 US disclosed
US-20090137591-A1 COMPOUNDS AND COMPOSITIONS AS PPAR MODULATORS IRM LLC (BM) 2009-05-28 US disclosed
EP-1843763-A2 COMPOUNDS AND COMPOSITIONS AS PPAR MODULATORS IRM, LLC (BM) 2007-10-17 EP disclosed
WO-2006084176-A2 COMPOUNDS AND COMPOSITIONS AS PPAR MODULATORS IRM LLC (BM) 2006-08-10 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-20090137591-A1 COMPOUNDS AND COMPOSITIONS AS PPAR MODULATORS PPARG, PPARD, PPARA HPGD 590/4885TSHR 589/4885KMT2A 3644/4885

“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.