SCHEMBL6133352

SCHEMBL6133352

C=CC(=O)OCC(CC)CCCC.C=CCOC(=O)C(=C)CC=CC(=O)O.C=COC(C)=O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.53
TDP1 Q9NUW8 2/20 0.35
CYP3A4 P08684 2/20 0.34
ATM Q13315 1/20 0.34
RECQL P46063 1/20 0.33
ALDH1A1 P00352 2/20 0.32
CA2 P00918 1/20 0.32
LMNA P02545 2/20 0.31
MAPK1 P28482 1/20 0.31
HPGD P15428 1/20 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
SCHEMBL7263170 0.85 TSHR (0.63) TSHRTDP1CYP3A4ATMRECQL
SCHEMBL6133318 0.84 TSHR (0.71) TSHRTDP1CYP3A4ATMRECQL
SCHEMBL2462155 0.83 TSHR (0.63) TSHRTDP1CYP3A4ATMRECQL
SCHEMBL516622 0.83 TSHR (0.66) TSHRTDP1CYP3A4ATMRECQL
Acrylic Acid SCHEMBL516623 0.82 TSHR (0.74) TSHRTDP1CYP3A4ATMRECQL
SCHEMBL560438 0.81 TSHR (0.81) TSHRTDP1CYP3A4ATMRECQL
SCHEMBL6133312 0.80 TSHR (0.64) TSHRTDP1CYP3A4ATMRECQL
SCHEMBL5025197 0.80 TSHR (0.58) TSHRTDP1CYP3A4ATMRECQL
SCHEMBL4125846 0.80 TSHR (0.58) TSHRTDP1CYP3A4ATMRECQL
Acrylic Acid SCHEMBL11282590 0.80 TSHR (0.71) TSHRTDP1CYP3A4ATMRECQL

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-20050226919-A1 Device for transdermal administration for the treatment of urinary tract disorders UCB PHARMA GMBH (DE) 2005-10-13 US disclosed
EP-1293198-B1 Device for transdermal administration for the treatment of urinary tract disorders SANOL ARZNEI SCHWARZ GMBH (DE) 2005-02-09 EP disclosed
EP-1293198-A1 Device for transdermal administration for the treatment of urinary tract disorders SCHWARZ PHARMA AG (DE) 2003-03-19 EP 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-20050226919-A1 Device for transdermal administration for the treatment of urinary tract disorders AR, CYP17A1, TACR1 TSHR 465/4885TDP1 4163/4885CYP3A4 880/4885

“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.