SCHEMBL5564747

SCHEMBL5564747

Cc1cc(CCCc2ccc(CO)c(CO)c2)ccc1OCC(O)C(C)c1ccccc1C

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 7/20 0.37
HPGD P15428 1/20 0.37
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
VDR P11473 3/20 0.36
FFAR1 O14842 4/20 0.35
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33

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
SCHEMBL5568696 0.80 FFAR4 (0.37) FFAR4HPGDVDRFFAR1
SCHEMBL5565459 0.78 VDR (0.53) VDR
SCHEMBL5570821 0.77 VDR (0.41) FFAR4HPGDVDRFFAR1
SCHEMBL5565702 0.74 ALDH1A1 (0.34) VDRADRB2
SCHEMBL5569702 0.72 FFAR4 (0.48) FFAR4HPGDFFAR1
SCHEMBL5564757 0.72 HPGD (0.40) FFAR4HPGDFFAR1ADRB2
SCHEMBL5568943 0.72 VDR (0.43) VDR
SCHEMBL5564748 0.71 MAPT (0.39) FFAR4HPGDKDM4EFFAR1
SCHEMBL5565476 0.70 VDR (0.51) FFAR4HPGDVDRFFAR1
SCHEMBL5570265 0.69 FFAR4 (0.35) FFAR4VDR

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-7312249-B2 Vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-12-25 US claimed
US-20050182144-A1 Novel vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-08-18 US claimed
US-7312249-B2 Vitamin D analogues GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-12-25 US 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 FFAR4 347/4885HPGD 82/4885KDM4E 2705/4885

“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.