SCHEMBL19236947

SCHEMBL19236947

CC(C)COC(=O)Cn1nc(C#N)c2cc(Br)ccc21

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ PFKFB2 O60825 1/20 0.40
▸ PFKFB1 P16118 1/20 0.40
▸ PFKFB3 Q16875 1/20 0.40
▸ GAA P10253 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.36
▸ MCL1 Q07820 1/20 0.35
▸ ELANE P08246 4/20 0.35
▸ AAK1 Q2M2I8 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ KRAS P01116 1/20 0.34
▸ MAPT P10636 2/20 0.33

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
SCHEMBL19236792 0.87 MAPT (0.47) PFKFB2PFKFB1PFKFB3TP53MCL1
SCHEMBL19208493 0.82 SMN1; SMN2 (0.45) SMN1; SMN2PFKFB2PFKFB1PFKFB3GAA
SCHEMBL19236884 0.81 CFD (0.40) TP53MCL1ELANELMNA
SCHEMBL19236948 0.80 PFKFB2 (0.41) PFKFB2PFKFB1PFKFB3TP53MAPT
SCHEMBL18555991 0.80 SMN1; SMN2 (0.43) SMN1; SMN2GAANPSR1ELANEKRAS
SCHEMBL23368304 0.79 SMN1; SMN2 (0.66) SMN1; SMN2GAANPSR1LMNAKRAS
SCHEMBL19237004 0.79 ELANE (0.39) PFKFB2PFKFB1PFKFB3TP53ELANE
SCHEMBL15541589 0.70 HTR6 (0.39) SMN1; SMN2PFKFB2PFKFB1PFKFB3GAA
SCHEMBL15542673 0.70 ELANE (0.39) SMN1; SMN2PFKFB2PFKFB1PFKFB3ELANE
SCHEMBL26619479 0.69 SMN1; SMN2 (0.41) SMN1; SMN2GAAELANELMNAMAPT

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-20230218578-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF WILMINGTON TRUST, NATIONAL ASSOCIATION 2023-07-13 — — US disclosed
EP-3411411-B3 1H-INDAZOLE-3-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS FACTOR D INHIBITORS FOR TREATING DISEASES CHARACTERIZED BY ABERRANT COMPLEMENT SYSTEM ACTIVITY, SUCH AS E.G. IMMUNOLOGICAL DISORDERS BIOCRYST PHARM INC (US) 2022-01-26 — — EP disclosed
EP-3925956-A1 1H-INDAZOLE-3-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS FACTOR D INHIBITORS FOR TREATING DISEASES CHARACTERIZED BY ABERRANT COMPLEMENT SYSTEM ACTIVITY, SUCH AS E.G. IMMUNOLOGICAL DISORDERS BioCryst Pharmaceuticals, Inc. (US) 2021-12-22 — — EP disclosed
EP-3411411-B1 1H-INDAZOLE-3-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS FACTOR D INHIBITORS FOR TREATING DISEASES CHARACTERIZED BY ABERRANT COMPLEMENT SYSTEM ACTIVITY, SUCH AS E.G. IMMUNOLOGICAL DISORDERS BIOCRYST PHARM INC (US) 2021-05-19 — — EP disclosed
WO-2017136395-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF BIOCRYST PHARMACEUTICALS, INC. (US) 2017-08-10 — — 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-20230218578-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF C9, C5, C1QBP SMN1; SMN2 2279/4885PFKFB2 1327/4885PFKFB1 1028/4885

“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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