SCHEMBL18330360

SCHEMBL18330360

CCNCC(=O)N[C@H]1CCN(C)C1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 9/20 0.39
SSTR1 P30872 5/20 0.39
ALDH1A1 P00352 1/20 0.37
DPP4 P27487 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
LMNA P02545 1/20 0.37
EPHX2 P34913 2/20 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
SCHEMBL18361889 0.88 MTNR1A (0.43) SSTR4SSTR1ALDH1A1SIGMAR1L3MBTL1
SCHEMBL358907 0.88 MTNR1A (0.43) SSTR4SSTR1ALDH1A1SIGMAR1L3MBTL1
SCHEMBL12162611 0.88 MTNR1A (0.43) SSTR4SSTR1ALDH1A1SIGMAR1L3MBTL1
SCHEMBL15337879 0.85 SSTR4 (0.40) SSTR4SSTR1ALDH1A1SIGMAR1
SCHEMBL25934538 0.85 SSTR4 (0.40) SSTR4SSTR1ALDH1A1SIGMAR1
SCHEMBL15337834 0.85 SSTR4 (0.40) SSTR4SSTR1ALDH1A1SIGMAR1
SCHEMBL10274562 0.81 MTNR1A (0.49) SSTR4SSTR1L3MBTL1
SCHEMBL20381540 0.81 SSTR4 (0.42) SSTR4SSTR1ALDH1A1DPP4
SCHEMBL2016900 0.80 LMNA (0.48) ALDH1A1DPP4L3MBTL1LMNAEPHX2
SCHEMBL12789759 0.79 SSTR4 (0.42) SSTR4SSTR1ALDH1A1SIGMAR1

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-20160368930-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2016-12-22 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-20160368930-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER KRAS, HRAS, NRAS SSTR4 4780/4885SSTR1 4783/4885ALDH1A1 2792/4885

“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.