Sugi Predict

Sugi Predict / Compounds / SCHEMBL28616115

SCHEMBL28616115

SCHEMBL28616115

N#C[Se]c1c[nH]c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IMPDH2 P12268 2/20 0.53
▸ IMPDH1 P20839 1/20 0.53
▸ APP P05067 1/20 0.45
▸ ATM Q13315 2/20 0.44
▸ GPR84 Q9NQS5 3/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ AHR P35869 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ CYP2A6 P11509 2/20 0.40
▸ MGAM O43451 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ SI P14410 1/20 0.39
▸ MGAM2 Q2M2H8 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ GPR3 P46089 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ MPO P05164 1/20 0.38

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
SCHEMBL28616801 0.79 NR4A2 (0.45) IMPDH2IMPDH1ALDH1A1
SCHEMBL11526080 0.77 ATM (0.52) IMPDH2IMPDH1ATMGPR84CYP3A4
SCHEMBL28907736 0.77 ATM (0.52) IMPDH2IMPDH1ATMGPR84CYP3A4
SCHEMBL28627511 0.75 SLC6A4 (0.46) IMPDH2IMPDH1HTR1BHTR2AHTR6
SCHEMBL28631910 0.75 CSNK2A1 (0.54) ATMGPR84MEN1MAPTKMT2A
SCHEMBL28616802 0.72 GPR84 (0.53) GPR84MEN1MAPTKMT2AALDH1A1
SCHEMBL28827211 0.71 ATM (0.45) IMPDH2IMPDH1ATMGPR84CYP3A4
SCHEMBL186741 0.69 IMPDH2 (1.00) IMPDH2IMPDH1APPATMGPR84
SCHEMBL29820843 0.69 IMPDH2 (1.00) IMPDH2IMPDH1APPATMGPR84
SCHEMBL28919212 0.69 GPR84 (0.47) IMPDH2IMPDH1ATMGPR84CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120118017-A Preparation method of 3-selenocyanoindole compound 周口师范学院 2025-06-10 — — CN claimed
CN-114213312-B Synthesis method of 3-selenocyanoindole compound promoted by visible light 南通大学 2024-04-26 — — CN claimed
CN-114213312-A Synthesis method of visible light promoted 3-selenocyanoindole compound 南通大学 2022-03-22 — — CN claimed
CN-109232363-B Synthetic method of 3-selenocyanoindole compound 安徽理工大学 2021-08-13 — — CN claimed
CN-120118017-A Preparation method of 3-selenocyanoindole compound 周口师范学院 2025-06-10 — — CN disclosed
CN-120118017-A Preparation method of 3-selenocyanoindole compound 周口师范学院 2025-06-10 — — CN disclosed
CN-120118017-A Preparation method of 3-selenocyanoindole compound 周口师范学院 2025-06-10 — — CN disclosed
CN-114213312-B Synthesis method of 3-selenocyanoindole compound promoted by visible light 南通大学 2024-04-26 — — CN disclosed
CN-114213312-B Synthesis method of 3-selenocyanoindole compound promoted by visible light 南通大学 2024-04-26 — — CN disclosed
CN-114213312-B Synthesis method of 3-selenocyanoindole compound promoted by visible light 南通大学 2024-04-26 — — CN disclosed
CN-114213312-A Synthesis method of visible light promoted 3-selenocyanoindole compound 南通大学 2022-03-22 — — CN disclosed
CN-114213312-A Synthesis method of visible light promoted 3-selenocyanoindole compound 南通大学 2022-03-22 — — CN disclosed
CN-114213312-A Synthesis method of visible light promoted 3-selenocyanoindole compound 南通大学 2022-03-22 — — CN disclosed
CN-109232363-B Synthetic method of 3-selenocyanoindole compound 安徽理工大学 2021-08-13 — — CN disclosed
CN-109232363-B Synthetic method of 3-selenocyanoindole compound 安徽理工大学 2021-08-13 — — CN disclosed
CN-109232363-B Synthetic method of 3-selenocyanoindole compound 安徽理工大学 2021-08-13 — — CN disclosed