SCHEMBL19208099

SCHEMBL19208099

CC(N)C(=O)Nc1cccc(Br)n1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 8/20 0.69
▸ BIRC2 Q13490 3/20 0.69
▸ GRM5 P41594 1/20 0.49
▸ CHRNB2 P17787 2/20 0.48
▸ CHRNA4 P43681 2/20 0.48
▸ CFD P00746 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ CHRNB4 P30926 1/20 0.44
▸ CHRNA3 P32297 1/20 0.44
▸ TAAR1 Q96RJ0 1/20 0.44
▸ NTRK1 P04629 1/20 0.42
▸ MAP4K4 O95819 1/20 0.42
▸ ROS1 P08922 1/20 0.42
▸ PIM1 P11309 1/20 0.42
▸ PHKG2 P15735 1/20 0.42
▸ CDK2 P24941 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ FLT3 P36888 1/20 0.42
▸ MAPKAPK2 P49137 1/20 0.42
▸ CLK2 P49760 1/20 0.42

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
SCHEMBL29781821 1.00 XIAP (0.69) XIAPBIRC2GRM5CHRNB2CHRNA4
SCHEMBL19208097 1.00 XIAP (0.69) XIAPBIRC2GRM5CHRNB2CHRNA4
SCHEMBL19208436 0.88 XIAP (0.54) XIAPBIRC2GRM5CHRNB2CHRNA4
SCHEMBL29781739 0.88 XIAP (0.54) XIAPBIRC2GRM5CHRNB2CHRNA4
SCHEMBL29781720 0.88 XIAP (0.54) XIAPBIRC2GRM5CHRNB2CHRNA4
SCHEMBL18555918 0.88 XIAP (0.54) XIAPBIRC2GRM5CHRNB2CHRNA4
SCHEMBL19208434 0.88 XIAP (0.54) XIAPBIRC2GRM5CHRNB2CHRNA4
SCHEMBL19208649 0.88 XIAP (0.54) XIAPBIRC2GRM5CHRNB2CHRNA4
SCHEMBL1861156 0.87 XIAP (0.51) XIAPBIRC2GRM5CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL18555933 0.82 XIAP (0.48) XIAPBIRC2GRM5CHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12485109-B2 Pyrrolo 12.3-dipyrimidine compounds and analogues thereof BIOCRYST PHARMACEUTICALS, INC. (US) 2025-12-02 — — US disclosed
EP-3925956-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) 2024-04-10 — — EP disclosed
US-20230218578-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF WILMINGTON TRUST, NATIONAL ASSOCIATION 2023-07-13 — — US disclosed
US-11559515-B2 Indole compounds and analogues thereof BIOCRYST PHARMACEUTICALS, INC. (US) 2023-01-24 — — US disclosed
CN-115490751-A Factor D inhibitors 拜奥克里斯特制药公司 2022-12-20 — — CN disclosed
CN-109121414-B Benzopyrazole compounds and analogs thereof 拜奥克里斯特制药公司 2022-07-05 — — CN 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
US-10849883-B2 Benzopyrazole compounds and analogues thereof BIOCRYST PHARMACEUTICALS, INC. (US) 2020-12-01 — — US disclosed
US-20190142802-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF BIOCRYST PHARMACEUTICALS, INC. (US) 2019-05-16 — — US disclosed
EP-3411411-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF Biocryst Pharmaceuticals, Inc. (US) 2018-12-12 — — 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 (5 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-12485109-B2 Pyrrolo 12.3-dipyrimidine compounds and analogues thereof C5, DPYD, C9 XIAP 890/4885BIRC2 2118/4885GRM5 2856/4885
US-20230218578-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF C9, C5, C1QBP XIAP 1773/4885BIRC2 2736/4885GRM5 3926/4885
US-11559515-B2 Indole compounds and analogues thereof C5, IDO1, IDO2 XIAP 102/4885BIRC2 658/4885GRM5 3351/4885
US-10849883-B2 Benzopyrazole compounds and analogues thereof C9, C5, C1QBP XIAP 1773/4885BIRC2 2736/4885GRM5 3926/4885
US-20190142802-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF C9, C5, C1QBP XIAP 1773/4885BIRC2 2736/4885GRM5 3926/4885

“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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