SCHEMBL2856590

SCHEMBL2856590

CCC(=O)c1ccc(O)c(CC)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.68
ALDH1A1 P00352 1/20 0.68
HPGD P15428 1/20 0.68
HSP90AB1 P08238 2/20 0.61
HSP90AA1 P07900 1/20 0.61
HSD17B1 P14061 1/20 0.56
PKM P14618 1/20 0.52
POLB P06746 1/20 0.49
ESR1 P03372 3/20 0.48
ESR2 Q92731 3/20 0.48
JAK2 O60674 1/20 0.47
ATM Q13315 1/20 0.47
BACE1 P56817 1/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP3A4 P08684 1/20 0.44
PTGS1 P23219 1/20 0.44

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
SCHEMBL14357335 0.89 PKM (0.68) HTTALDH1A1HPGDHSP90AB1HSP90AA1
SCHEMBL1024088 0.87 HTT (0.62) HTTALDH1A1HPGDHSP90AB1HSP90AA1
SCHEMBL6756073 0.86 HSP90AA1 (0.64) HTTALDH1A1HPGDHSP90AB1HSP90AA1
Hydrochloric Acid SCHEMBL10743936 0.85 HTT (0.60) HTTALDH1A1HPGDHSP90AB1HSP90AA1
SCHEMBL8772648 0.85 HSP90AA1 (0.57) HTTALDH1A1HPGDHSP90AB1HSP90AA1
SCHEMBL5465657 0.85 HSP90AA1 (0.57) HTTALDH1A1HPGDHSP90AB1HSP90AA1
SCHEMBL27564987 0.84 ALDH1A1 (0.54) HTTALDH1A1HPGDHSP90AB1HSP90AA1
SCHEMBL8252051 0.84 HTT (0.59) HTTALDH1A1HPGDHSP90AB1HSP90AA1
SCHEMBL9763047 0.83 HSP90AA1 (0.65) HTTALDH1A1HPGDHSP90AB1HSP90AA1
SCHEMBL2991009 0.83 CA12 (0.58) HTTALDH1A1HPGDPOLBATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1582250-B2 Absorbent with improved oxidation resistance and process for deacidifying fluid fluxes BASF SE (DE) 2022-03-09 EP disclosed
EP-1582250-B1 Absorbent with improved oxidation resistance and process for deacidifying fluid fluxes BASF SE (DE) 2013-05-15 EP disclosed
US-7786122-B2 α-(N-sulfonamido)acetamide derivatives as β-amyloid inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-08-31 US disclosed
EP-1456160-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2010-01-20 EP disclosed
US-20080085894-A1 ALPHA-(N-SULFONAMIDO)ACETAMIDE DERIVATIVES AS BETA-AMYLOID INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2008-04-10 US disclosed
EP-1582250-A2 Absorbent with improved ocidation resistance and process for deacidifying fluid fluxes BASF AKTIENGESELLSCHAFT (DE) 2005-10-05 EP disclosed
US-6924400-B2 Triaromatic vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT, SNC (FR) 2005-08-02 US disclosed
EP-1456160-A2 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2004-09-15 EP disclosed
US-20030195259-A1 Triaromatic vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT (FR) 2003-10-16 US disclosed
WO-2003050067-A2 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, SNC (FR) 2003-06-19 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 (2 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-20080085894-A1 ALPHA-(N-SULFONAMIDO)ACETAMIDE DERIVATIVES AS BETA-AMYLOID INHIBITORS APP, APBA1, BACE1 HTT 384/4885ALDH1A1 1197/4885HPGD 3387/4885
US-20030195259-A1 Triaromatic vitamin D analogues CYP24A1, CYP2R1, VDR HTT 2386/4885ALDH1A1 151/4885HPGD 85/4885

“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.