SCHEMBL5834244

SCHEMBL5834244

CC(C)(C)OC(=O)N1CCCC1C(=O)C(CCc1ccccc1)CCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KLK7 P49862 1/20 0.52
FKBP1A P62942 10/20 0.51
ACE P12821 3/20 0.50
UCHL1 P09936 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
NPC1 O15118 1/20 0.47
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL5833863 0.97 FKBP1A (0.54) KLK7FKBP1AACEUCHL1MEN1
SCHEMBL5834113 0.83 FKBP1A (0.59) FKBP1AACE
SCHEMBL7654989 0.82 ACE (0.51) FKBP1AACE
SCHEMBL13086449 0.81 KLK7 (0.53) KLK7FKBP1AMEN1KMT2ANPC1
SCHEMBL5833963 0.81 FKBP1A (0.69) FKBP1A
SCHEMBL5244800 0.81 KLK7 (0.55) KLK7FKBP1AUCHL1MEN1KMT2A
SCHEMBL25338280 0.80 KLK7 (0.57) KLK7ACEUCHL1MEN1KMT2A
SCHEMBL20595807 0.80 KLK7 (0.57) KLK7ACEUCHL1MEN1KMT2A
SCHEMBL5834096 0.80 FKBP1A (0.64) FKBP1AACE
SCHEMBL5833607 0.80 FKBP1A (0.67) FKBP1A

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-7056935-B2 Rotamase enzyme activity inhibitors GPI NIL HOLDINGS, INC. (US) 2006-06-06 US disclosed
US-20020052410-A1 Administering to the animal suffering from neurological disorders an amide compound having an affinity for FKBP-type immunophilins GLIAMED, INC. 2002-05-02 US disclosed
US-20020042377-A1 Rotamase enzyme activity inhibitors GUILFORD PHARMACEUTICALS INC. 2002-04-11 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 (2 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-20020052410-A1 Administering to the animal suffering from neurological disorders an amide compound having an affinity for FKBP-type immunophilins FKBP14, FKBP1A, FKBP2 KLK7 2704/4885FKBP1A 2/4885ACE 3581/4885
US-20020042377-A1 Rotamase enzyme activity inhibitors BDNF, FKBP1A, FKBP14 KLK7 2310/4885FKBP1A 2/4885ACE 837/4885

“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.