SCHEMBL5565709

SCHEMBL5565709

O=C(O)c1ccc(OS(=O)(=O)C(F)(F)F)cc1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
HSD11B1 P28845 1/20 0.48
POLB P06746 2/20 0.45
APEX1 P27695 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CXCR2 P25025 2/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CXCR1 P25024 1/20 0.41
HTR1A P08908 2/20 0.40
HTR1D P28221 2/20 0.40
HTR1B P28222 2/20 0.40
HPSE Q9Y251 1/20 0.39
KDM4E B2RXH2 3/20 0.39
HSD17B10 Q99714 3/20 0.39
HPGD P15428 2/20 0.39
AKR1C3 P42330 1/20 0.38
AKR1C2 P52895 1/20 0.38
USP2 O75604 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
SCHEMBL3902735 0.86 HSD11B1 (0.46) ALDH1A1HSD11B1POLBAPEX1CTDSP1
SCHEMBL9470357 0.86 HSD11B1 (0.46) ALDH1A1HSD11B1POLBCXCR2CA1
SCHEMBL11689461 0.83 ALDH1A1 (0.56) ALDH1A1POLBAPEX1CTDSP1L3MBTL1
SCHEMBL3198514 0.82 ALDH1A1 (0.51) ALDH1A1HSD11B1CXCR2KDM4EHSD17B10
SCHEMBL5569165 0.80 HSD11B1 (0.47) ALDH1A1HSD11B1CXCR2CA1CA2
SCHEMBL11779341 0.80 ALDH1A1 (0.58) ALDH1A1POLBAPEX1CTDSP1L3MBTL1
SCHEMBL3181925 0.80 KDM4E (0.49) ALDH1A1HSD11B1L3MBTL1CXCR2HTR1A
SCHEMBL6551724 0.79 HSD11B1 (0.46) HSD11B1CXCR2CA1CA2CXCR1
SCHEMBL3201334 0.79 ALDH1A1 (0.53) ALDH1A1HSD11B1CXCR2CXCR1KDM4E
SCHEMBL903987 0.78 KDM4E (0.45) ALDH1A1HSD11B1POLBKDM4EAKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7312249-B2 Vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-12-25 US disclosed
EP-1537065-B1 ANALOGUES OF VITAMIN D GALDERMA RES & DEV (FR) 2006-11-02 EP disclosed
US-20050182144-A1 Novel vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-08-18 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-20050182144-A1 Novel vitamin D analogues CYP24A1, CYP2R1, VDR ALDH1A1 121/4885HSD11B1 51/4885POLB 3120/4885

“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.