SCHEMBL18212461

SCHEMBL18212461

C[C@@H](C(=O)N1CCCC1)C1CC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.49
DPP7 Q9UHL4 4/20 0.49
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HPGD P15428 2/20 0.40
HTT P42858 1/20 0.38
RIPK1 Q13546 1/20 0.37
USP30 Q70CQ3 3/20 0.37
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP8 P22894 1/20 0.37
TP53 P04637 1/20 0.37
CHRM3 P20309 1/20 0.36

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
SCHEMBL18212496 1.00 DPP4 (0.49) DPP4DPP7ALDH1A1MEN1KMT2A
SCHEMBL8396870 0.74 DPP7 (0.49) DPP4DPP7ALDH1A1MEN1KMT2A
SCHEMBL14656014 0.74 DPP4 (0.73) DPP4DPP7
SCHEMBL1106510 0.74 CHRNB2 (0.46) DPP4DPP7ALDH1A1MEN1KMT2A
SCHEMBL8392251 0.72 DPP7 (0.47) DPP4DPP7ALDH1A1MEN1KMT2A
SCHEMBL8395548 0.72 DPP7 (0.47) DPP4DPP7ALDH1A1MEN1KMT2A
SCHEMBL25447805 0.72 ALDH1A1 (0.48) DPP4DPP7ALDH1A1HPGDHTT
SCHEMBL8014381 0.72 ALDH1A1 (0.48) DPP4DPP7ALDH1A1HPGDHTT
SCHEMBL21455835 0.72 ALDH1A1 (0.48) DPP4DPP7ALDH1A1HPGDHTT
SCHEMBL3288873 0.72 MMP1 (0.44) DPP4DPP7ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160326124-A1 HISTONE DEACETYLASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF CHDI FOUNDATION, INC. 2016-11-10 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-20160326124-A1 HISTONE DEACETYLASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF HDAC1, HDAC7, HDAC5 DPP4 1461/4885DPP7 581/4885ALDH1A1 559/4885

“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.