SCHEMBL22209388

SCHEMBL22209388

O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1cccc(OC(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PREP P48147 8/20 0.58
▸ GPR139 Q6DWJ6 1/20 0.50
▸ CCR2 P41597 1/20 0.50
▸ TAS1R3 Q7RTX0 1/20 0.48
▸ TAS1R1 Q7RTX1 1/20 0.48
▸ TAS1R2 Q8TE23 1/20 0.48
▸ DPP4 P27487 2/20 0.48
▸ FAP Q12884 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ NAMPT P43490 1/20 0.47
▸ DPP7 Q9UHL4 1/20 0.47
▸ LOXL2 Q9Y4K0 2/20 0.46
▸ CHRM3 P20309 1/20 0.45
▸ ACE P12821 1/20 0.45
▸ ACE2 Q9BYF1 1/20 0.45

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
SCHEMBL22811348 0.81 PREP (0.69) PREPDPP4FAPDPP7ACE
SCHEMBL22209470 0.81 PREP (0.69) PREPDPP4FAPDPP7ACE
SCHEMBL27147721 0.81 PREP (0.52) PREPDPP4FAPDPP7LOXL2
SCHEMBL32680841 0.81 PREP (0.52) PREPDPP4FAPDPP7LOXL2
SCHEMBL22811105 0.80 ACE (0.52) PREPGPR139TAS1R3TAS1R1TAS1R2
SCHEMBL22468385 0.80 NPC1 (0.61) PREPDPP4FAPNPC1GAA
SCHEMBL28661857 0.80 NPC1 (0.61) PREPDPP4FAPNPC1GAA
SCHEMBL22798165 0.79 CMA1 (0.51) TAS1R3TAS1R1TAS1R2ACEACE2
SCHEMBL22209387 0.79 CMA1 (0.51) TAS1R3TAS1R1TAS1R2ACEACE2
SCHEMBL22209407 0.79 DPP4 (0.62) PREPDPP4FAPNPC1GAA

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-10711036-B2 MALT1 inhibitors and uses thereof CORNELL UNIVERSITY (US) 2020-07-14 — — 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-10711036-B2 MALT1 inhibitors and uses thereof MALT1, BCL3, BCL6 PREP 1162/4885GPR139 3879/4885CCR2 3171/4885

“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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