SCHEMBL21348801

SCHEMBL21348801

CN1CCC[C@@H]1CNC(=O)c1ccccc1F

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.58
POLR1A O95602 1/20 0.53
CHRM3 P20309 4/20 0.50
DRD2 P14416 1/20 0.48
HCN1 O60741 1/20 0.48
BCL3 P20749 1/20 0.48

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
SCHEMBL21348806 0.85 DPP4 (0.57) DPP4POLR1ADRD2
SCHEMBL13162932 0.82 TP53 (0.53) POLR1ADRD2HCN1
SCHEMBL19849442 0.81 POLR1A (0.50) DPP4POLR1ADRD2
SCHEMBL8049469 0.81 CTSL (0.67) DPP4
SCHEMBL18588481 0.78 POLR1A (0.48) DPP4POLR1ADRD2
SCHEMBL5949338 0.77 KMT2A (0.47) CHRM3
SCHEMBL29857237 0.77 ALDH1A1 (0.56) CHRM3
SCHEMBL21716773 0.77 POLR1A (0.46) DPP4POLR1ADRD2
SCHEMBL20356852 0.77 POLR1A (0.46) DPP4POLR1ADRD2
SCHEMBL11273600 0.76 HTR4 (0.63)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10556898-B2 Indazolyl-1,2,4-thiadiazolamines and related compounds for inhibition of Rho-associated protein kinase and the treatment of disease LYCERA CORPORATION (US) 2020-02-11 US disclosed
US-20190276447-A1 INDAZOLYL-1,2,4-THIADIAZOLAMINES AND RELATED COMPOUNDS FOR INHIBITION OF RHO-ASSOCIATED PROTEIN KINASE AND THE TREATMENT OF DISEASE LYCERA CORPORATION 2019-09-12 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 (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-20190276447-A1 INDAZOLYL-1,2,4-THIADIAZOLAMINES AND RELATED COMPOUNDS FOR INHIBITION OF RHO-ASSOCIATED PROTEIN KINASE AND THE TREATMENT OF DISEASE ROCK1, ROCK2, TNK2 DPP4 3119/4885POLR1A 4816/4885CHRM3 1891/4885
US-10556898-B2 Indazolyl-1,2,4-thiadiazolamines and related compounds for inhibition of Rho-associated protein kinase and the treatment of disease ROCK1, ROCK2, TNK2 DPP4 3119/4885POLR1A 4816/4885CHRM3 1891/4885

“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.