SCHEMBL28690449

SCHEMBL28690449

NC(=O)Oc1ccc(I)nn1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NNMT P40261 3/20 0.40
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KIF11 P52732 1/20 0.30

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
SCHEMBL4052104 0.87 NNMT (0.48) NNMTMEN1KMT2AKIF11
SCHEMBL15881082 0.76 ALDH1A1 (0.41) NNMTMEN1KMT2A
SCHEMBL28941021 0.76 NNMT (0.44) NNMTMEN1KMT2AKIF11
SCHEMBL28572641 0.73 NNMT (0.38) NNMTMEN1KMT2A
SCHEMBL28574759 0.72 NNMT (0.37) NNMTMEN1KMT2A
SCHEMBL20639594 0.71 NNMT (0.41) NNMTMEN1KMT2A
SCHEMBL19667223 0.68 MEN1 (0.33) NNMTMEN1KMT2AKIF11
SCHEMBL25381420 0.68 SIRT6 (0.39) NNMTMEN1KMT2A
SCHEMBL10847338 0.68 P2RX7 (0.43) NNMTMEN1KMT2AKIF11
SCHEMBL8539378 0.68 MEN1 (0.36) NNMTMEN1KMT2AKIF11

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
CN-117903169-A Pan-KRAS inhibitor compound 杭州阿诺生物医药科技有限公司 2024-04-19 CN disclosed
CN-107921044-B GLS1 inhibitors for the treatment of disease 德州大学系统董事会 2022-01-21 CN disclosed