SCHEMBL16558239

SCHEMBL16558239

CC(O)[C@H]1NC(=O)CCCCCCNC(=O)[C@@H](CO)NC(=O)N[C@H](CC(N)=O)C(=O)NNC1=O

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 15/20 0.43
▸ GRB2 P62993 3/20 0.41
▸ OXTR P30559 1/20 0.37

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
SCHEMBL16558260 1.00 CTSD (0.43) CTSDGRB2OXTR
SCHEMBL18735829 1.00 CTSD (0.43) CTSDGRB2OXTR
SCHEMBL18735662 0.94 CTSD (0.43) CTSDGRB2OXTR
SCHEMBL16558253 0.94 CTSD (0.43) CTSDGRB2OXTR
SCHEMBL18719718 0.93 CTSD (0.47) CTSDGRB2
SCHEMBL18719739 0.91 CTSD (0.44) CTSD
SCHEMBL18735659 0.91 CTSD (0.42) CTSDGRB2OXTR
SCHEMBL18719736 0.85 CTSD (0.44) CTSDGRB2
SCHEMBL16558245 0.82 CTSD (0.32) CTSDOXTR
SCHEMBL18735644 0.82 CTSD (0.32) CTSDOXTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3041468-B1 CYCLIC PEPTIDOMIMETIC COMPOUNDS AS IMMUNOMODULATORS AURIGENE DISCOVERY TECH LTD (IN) 2018-06-13 — — EP disclosed
US-20170101444-A1 Cyclic Peptidomimetic Compounds as Immunomodulators AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2017-04-13 — — US disclosed
US-20170101444-A1 Cyclic Peptidomimetic Compounds as Immunomodulators AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2017-04-13 — — US disclosed
US-20160113901-A1 Cyclic Peptidomimetic Compounds as Immunomodulators AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2016-04-28 — — US disclosed
US-20160113901-A1 Cyclic Peptidomimetic Compounds as Immunomodulators AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2016-04-28 — — US disclosed
US-9233940-B2 Cyclic peptidomimetic compounds as immunomodulators AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2016-01-12 — — US disclosed
US-9233940-B2 Cyclic peptidomimetic compounds as immunomodulators AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2016-01-12 — — US disclosed
US-20150073042-A1 Cyclic Peptidomimetic Compounds as Immunomodulators AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2015-03-12 — — US disclosed
WO-2015033303-A1 CYCLIC PEPTIDOMIMETIC COMPOUNDS AS IMMUNOMODULATORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2015-03-12 — — WO disclosed
US-20150073042-A1 Cyclic Peptidomimetic Compounds as Immunomodulators AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2015-03-12 — — 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 (3 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-20160113901-A1 Cyclic Peptidomimetic Compounds as Immunomodulators CD274, PDCD1LG2, PDCD1 CTSD 1311/4885GRB2 422/4885OXTR 3260/4885
US-20150073042-A1 Cyclic Peptidomimetic Compounds as Immunomodulators CD274, PDCD1LG2, PDCD1 CTSD 1311/4885GRB2 422/4885OXTR 3260/4885
US-20170101444-A1 Cyclic Peptidomimetic Compounds as Immunomodulators CD274, PDCD1LG2, PDCD1 CTSD 1311/4885GRB2 422/4885OXTR 3260/4885

“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.

Send feedback