SCHEMBL3598519

SCHEMBL3598519

CCC(C)[C@H](NC(=O)OCC(C)C)C(=O)N1CC[C@H]1C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.40
XIAP P98170 1/20 0.37
RAB9A P51151 1/20 0.36
ENPEP Q07075 4/20 0.36
DPP4 P27487 4/20 0.36
L3MBTL1 Q9Y468 3/20 0.35
KMT2A Q03164 1/20 0.35
CCR1 P32246 1/20 0.34
PLG P00747 1/20 0.34
PLAU P00749 1/20 0.34
PIN1 Q13526 2/20 0.33
LMNA P02545 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
FAP Q12884 2/20 0.32
DPP8 Q6V1X1 2/20 0.32
DPP9 Q86TI2 2/20 0.32
DPP7 Q9UHL4 2/20 0.32

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
SCHEMBL3605950 0.92 RAB9A (0.42) SMN1; SMN2XIAPRAB9ADPP4L3MBTL1
SCHEMBL3598521 0.84 CTSK (0.46) KMT2AHDAC8
SCHEMBL3612571 0.81 DPP4 (0.48) SMN1; SMN2DPP4
SCHEMBL27485070 0.77 POLB (0.48) XIAPKMT2AHDAC8
SCHEMBL3604870 0.77 POLB (0.48) XIAPKMT2AHDAC8
SCHEMBL5696171 0.77 POLB (0.48) XIAPKMT2AHDAC8
SCHEMBL5696170 0.77 POLB (0.48) XIAPKMT2AHDAC8
SCHEMBL3605952 0.76 POLB (0.46) XIAPKMT2AHDAC8
SCHEMBL11341773 0.76 PREP (0.54) RAB9AL3MBTL1KMT2ACCR1LMNA
SCHEMBL11341775 0.76 PREP (0.54) RAB9AL3MBTL1KMT2ACCR1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183280-B2 FAP inhibitors VANTIA LIMITED (GB) 2012-05-22 US disclosed
US-20100081701-A1 FAP inhibitors VANTIA LIMITED (GB) 2010-04-01 US disclosed
EP-1919864-A2 FAP INHIBITORS Ferring B.V. (NL) 2008-05-14 EP disclosed
WO-2007085895-A2 FAP INHIBITORS FERRING B.V. (US) 2007-08-02 WO 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-20100081701-A1 FAP inhibitors FAP, APC, SERPINB1 SMN1; SMN2 2583/4885XIAP 594/4885RAB9A 1548/4885

“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.