SCHEMBL18619567

SCHEMBL18619567

N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)OCc1ccccc1)c1cccnc1)C(=O)CF

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MALT1 Q9UDY8 1/20 0.52
▸ TGM2 P21980 1/20 0.41
▸ DPP4 P27487 2/20 0.40
▸ DPP8 Q6V1X1 2/20 0.40
▸ ACE P12821 2/20 0.40
▸ DPP9 Q86TI2 1/20 0.40
▸ DPP7 Q9UHL4 1/20 0.40
▸ HTRA1 Q92743 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ F10 P00742 4/20 0.39
▸ PRSS1 P07477 2/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ ELANE P08246 1/20 0.38
▸ PLG P00747 2/20 0.38
▸ TMPRSS11D O60235 1/20 0.38
▸ F2 P00734 1/20 0.38
▸ OPRM1 P35372 2/20 0.38
▸ OPRK1 P41145 2/20 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
SCHEMBL18619574 1.00 MALT1 (0.52) MALT1TGM2DPP4DPP8ACE
SCHEMBL18619580 0.94 MALT1 (0.47) MALT1TGM2DPP4DPP8ACE
SCHEMBL18619573 0.93 MALT1 (0.53) MALT1DPP4DPP8ACEDPP9
SCHEMBL20485178 0.90 MALT1 (0.41) MALT1PRSS1KCNH2ELANEF2
SCHEMBL20484723 0.90 MALT1 (0.41) MALT1PRSS1KCNH2ELANEF2
SCHEMBL20484726 0.90 MALT1 (0.41) MALT1PRSS1KCNH2ELANEF2
SCHEMBL20484728 0.90 MALT1 (0.41) MALT1PRSS1KCNH2ELANEF2
SCHEMBL20485182 0.90 MALT1 (0.41) MALT1PRSS1KCNH2ELANEF2
SCHEMBL18619636 0.86 MALT1 (0.55) MALT1DPP4DPP8ACEPRSS1
SCHEMBL22209464 0.86 MALT1 (0.57) MALT1DPP4DPP8ACEDPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3341007-B1 MALT1 INHIBITORS AND USES THEREOF UNIV CORNELL (US) 2020-12-23 — — EP disclosed
US-10711036-B2 MALT1 inhibitors and uses thereof CORNELL UNIVERSITY (US) 2020-07-14 — — US disclosed
WO-2017040304-A1 MALT1 INHIBITORS AND USES THEREOF CORNELL UNIVERSITY (US) 2017-03-09 — — 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-10711036-B2 MALT1 inhibitors and uses thereof MALT1, BCL3, BCL6 MALT1 1/4885TGM2 1546/4885DPP4 2242/4885

“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.

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