SCHEMBL24752249

SCHEMBL24752249

CONC(=O)c1ccc(Nc2ncc(F)c(Nc3ccccc3P(C)(C)=O)n2)cc1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AURKA O14965 11/20 0.58
AURKB Q96GD4 4/20 0.56
JAK2 O60674 3/20 0.56
PTK2 Q05397 8/20 0.56
GSK3A P49840 1/20 0.53
GSK3B P49841 1/20 0.53
CDK2 P24941 1/20 0.53

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
SCHEMBL30184428 1.00 AURKA (0.58) AURKAAURKBJAK2PTK2GSK3A
SCHEMBL30184231 0.89 PTK2 (0.69) PTK2
SCHEMBL30002994 0.89 PTK2 (0.55) PTK2GSK3B
SCHEMBL24752678 0.89 PTK2 (0.69) PTK2
SCHEMBL24752251 0.89 PTK2 (0.55) PTK2GSK3B
SCHEMBL24752727 0.88 PTK2 (0.65) JAK2PTK2GSK3AGSK3B
SCHEMBL30184426 0.88 PTK2 (0.54) AURKAPTK2
SCHEMBL28969587 0.88 PTK2 (0.54) AURKAJAK2PTK2
SCHEMBL28969639 0.88 PTK2 (0.54) AURKAPTK2
SCHEMBL24752245 0.87 PTK2 (0.57) JAK2PTK2

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
CN-116870016-B Heteroaromatic compound and medical application thereof 希格生科(深圳)有限公司 2024-05-28 CN disclosed
CN-117412981-A Phosphine oxide derivative and preparation method and application thereof 希格生科(深圳)有限公司 2024-01-16 CN disclosed
CN-116870016-A Heteroaromatic compound and medical application thereof 希格生科(深圳)有限公司 2023-10-13 CN disclosed
CN-115785154-A Heteroaromatic ring compounds and medical use thereof 希格生科(深圳)有限公司 2023-03-14 CN disclosed
WO-2022253081-A1 PHOSPHINE OXIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 希格生科(深圳)有限公司 2022-12-08 WO disclosed