SCHEMBL11985167

SCHEMBL11985167

CC(OC(=O)c1ccc(O)o1)OC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 10/20 0.51
▸ PREP P48147 3/20 0.48
▸ KLK7 P49862 1/20 0.47
▸ KLK5 Q9Y337 1/20 0.47
▸ ACE P12821 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ GFER P55789 1/20 0.44
▸ CTRB1 P17538 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
SCHEMBL11980677 0.92 FKBP1A (0.50) FKBP1APREPKLK7KLK5ACE
SCHEMBL993838 0.85 PRCP (0.46) FKBP1APREPKLK7KLK5ACE
SCHEMBL993837 0.85 PRCP (0.46) FKBP1APREPKLK7KLK5ACE
SCHEMBL14865075 0.82 FKBP1A (0.60) FKBP1APREPKLK7KLK5KDM4E
SCHEMBL19442013 0.81 FKBP1A (0.53) FKBP1APREPKLK7KLK5ACE
SCHEMBL7326760 0.78 FKBP1A (0.66) FKBP1APREPKLK7KLK5KDM4E
SCHEMBL16272917 0.78 FKBP1A (0.66) FKBP1APREPKLK7KLK5KDM4E
SCHEMBL31257539 0.77 FKBP1A (0.72) FKBP1APREPKLK7KLK5KDM4E
SCHEMBL6788139 0.76 FKBP1A (0.64) FKBP1APREPACE
SCHEMBL11940447 0.76 FKBP1A (0.64) FKBP1APREPACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9782382-B2 TOFA analogs useful in treating dermatological disorders or conditions DERMIRA (CANADA), INC. (US) 2017-10-10 — — US disclosed
US-20120208807-A1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS Valocor Therapeutics, Inc. (CA) 2012-08-16 — — 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-20120208807-A1 TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS FAH, CUTA, ALOX5AP FKBP1A 412/4885PREP 2238/4885KLK7 3596/4885

“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.

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