SCHEMBL24982010

SCHEMBL24982010

Cn1c(=O)oc2ccc(-c3cc(F)c(CC(N)C#N)cn3)cc21

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 11/20 0.46
GPR55 Q9Y2T6 3/20 0.44
CTSC P53634 5/20 0.44
CTSK P43235 1/20 0.37
PLG P00747 1/20 0.34

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
SCHEMBL28696393 0.86 CTSC (0.56) KCNJ1GPR55CTSCCTSK
SCHEMBL24981975 0.86 CTSC (0.56) KCNJ1GPR55CTSCCTSK
SCHEMBL30738958 0.84 CTSC (0.48) KCNJ1GPR55CTSCCTSKPLG
SCHEMBL25146487 0.83 KCNJ1 (0.56) KCNJ1GPR55CTSC
SCHEMBL24982008 0.82 KCNJ1 (0.43) KCNJ1GPR55CTSCCTSK
SCHEMBL32680807 0.79 CTSC (0.49) KCNJ1GPR55CTSCCTSK
SCHEMBL29455670 0.79 CTSC (0.49) KCNJ1GPR55CTSCCTSK
SCHEMBL24981841 0.79 CTSC (0.42) KCNJ1GPR55CTSCCTSK
SCHEMBL30738912 0.79 CTSC (0.42) KCNJ1GPR55CTSCCTSK
SCHEMBL24981587 0.79 KCNJ1 (0.46) KCNJ1GPR55CTSC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11807635-B2 Nitrile derivative that acts as inhibitor of dipeptidyl peptidase 1 and use thereof HAISCO PHARMACEUTICALS PTE. LTD. (SG) 2023-11-07 US disclosed
US-11807635-B2 Nitrile derivative that acts as inhibitor of dipeptidyl peptidase 1 and use thereof HAISCO PHARMACEUTICALS PTE. LTD. (SG) 2023-11-07 US disclosed
CN-115996923-A Nitrile derivative as dipeptidyl peptidase 1 inhibitor and application thereof 四川海思科制药有限公司 2023-04-21 CN disclosed
US-20230121807-A1 NITRILE DERIVATIVE THAT ACTS AS INHIBITOR OF DIPEPTIDYL PEPTIDASE 1 AND USE THEREOF HAISCO PHARMACEUTICALS PTE. LTD (SG) 2023-04-20 US disclosed
EP-4129989-A1 NITRILE DERIVATIVE THAT ACTS AS INHIBITOR OF DIPEPTIDYL PEPTIDASE 1 AND USE THEREOF Haisco Pharmaceuticals Pte. Ltd. (SG) 2023-02-08 EP 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 (2 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-11807635-B2 Nitrile derivative that acts as inhibitor of dipeptidyl peptidase 1 and use thereof DPP4, DPP3, DPP9 KCNJ1 3424/4885GPR55 4171/4885CTSC 4/4885
US-20230121807-A1 NITRILE DERIVATIVE THAT ACTS AS INHIBITOR OF DIPEPTIDYL PEPTIDASE 1 AND USE THEREOF DPP4, DPP3, DPP9 KCNJ1 3424/4885GPR55 4171/4885CTSC 4/4885

“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.