SCHEMBL5569128

SCHEMBL5569128

CCc1cc(CCCc2ccc(C(O)O)cc2)ccc1C=CC(O)C(C(F)(F)F)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.34
SPHK2 Q9NRA0 1/20 0.34
FAAH O00519 1/20 0.32
S1PR4 O95977 3/20 0.32
S1PR1 P21453 3/20 0.32
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
S1PR5 Q9H228 2/20 0.30

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
SCHEMBL5569124 0.87 VDR (0.35) SPHK1SPHK2S1PR4S1PR1S1PR5
SCHEMBL5569129 0.87 VDR (0.35) SPHK1SPHK2S1PR4S1PR1S1PR5
SCHEMBL5569682 0.86 SPHK1 (0.33) SPHK1SPHK2
SCHEMBL5569623 0.83
SCHEMBL5569797 0.83 PGR (0.34) SPHK1SPHK2S1PR4S1PR1PPARA
SCHEMBL5569679 0.76 VDR (0.33) SPHK1SPHK2
SCHEMBL5569685 0.76 VDR (0.33) SPHK1SPHK2
SCHEMBL5565478 0.75 VDR (0.36) SPHK1SPHK2S1PR4S1PR1PPARD
SCHEMBL5565480 0.75 VDR (0.36) SPHK1SPHK2S1PR4S1PR1PPARD
SCHEMBL5565717 0.74 CYP17A1 (0.33)

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 SPHK1 2476/4885SPHK2 2823/4885FAAH 371/4885

“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.