SCHEMBL14595385

SCHEMBL14595385

CCN1CCN(C(=O)CC(C)(C)CC(=O)O)CC1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 6/20 0.47
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
RAB9A P51151 1/20 0.40
KDM1A O60341 1/20 0.38

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
SCHEMBL15696989 0.82 HSD11B1 (0.51) HSD11B1KDM4EALDH1A1KMT2AMEN1
SCHEMBL20349499 0.77 HSD11B1 (0.47) HSD11B1KDM4EALDH1A1KMT2AMEN1
SCHEMBL19004888 0.77 HSD11B1 (0.50) HSD11B1KDM4EALDH1A1TDP1KMT2A
SCHEMBL14595389 0.76 HSD11B1 (0.54) HSD11B1KDM4EALDH1A1TDP1KMT2A
SCHEMBL16353728 0.74 HSD11B1 (0.56) HSD11B1KDM4EALDH1A1TDP1KMT2A
SCHEMBL84852 0.73 HSD11B1 (0.55) HSD11B1KDM4EALDH1A1KMT2AMEN1
SCHEMBL5605768 0.71 HSD11B1 (0.53) HSD11B1KDM4EALDH1A1TDP1KMT2A
SCHEMBL16938386 0.71 HSD11B1 (0.61) HSD11B1KDM4EALDH1A1TDP1KMT2A
SCHEMBL8213345 0.71 HSD11B1 (0.56) HSD11B1KDM4EALDH1A1KMT2AMEN1
SCHEMBL2748651 0.71 KDM4E (0.53) HSD11B1KDM4EALDH1A1TDP1

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-20070015766-A1 Quinoline Derivatives as NK-3 and NK-2 Antagonists GlaxoSmithKline S.P.A. & Laboratoire 2007-01-18 US disclosed
US-20070015766-A1 Quinoline Derivatives as NK-3 and NK-2 Antagonists GlaxoSmithKline S.P.A. & Laboratoire 2007-01-18 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-20070015766-A1 Quinoline Derivatives as NK-3 and NK-2 Antagonists KCNK3, KCNQ3, ACKR3 HSD11B1 2234/4885KDM4E 2581/4885ALDH1A1 3182/4885

“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.