SCHEMBL29069393

SCHEMBL29069393

NC(=O)c1cc2c(F)cncc2s1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ICAM1 P05362 10/20 0.69
▸ SELE P16581 9/20 0.69
▸ VCAM1 P19320 4/20 0.69
▸ PIM1 P11309 9/20 0.66
▸ GSK3A P49840 9/20 0.66
▸ GSK3B P49841 9/20 0.66
▸ CDK5 Q00535 9/20 0.66
▸ CDK1 P06493 8/20 0.66
▸ CDK2 P24941 8/20 0.66
▸ DYRK1A Q13627 8/20 0.66
▸ PRKACA P17612 8/20 0.66
▸ KDR P35968 7/20 0.66
▸ CSNK1D P48730 7/20 0.66
▸ PLK1 P53350 7/20 0.66
▸ PRKCD Q05655 7/20 0.66
▸ PLK3 Q9H4B4 7/20 0.66
▸ SGK2 Q9HBY8 7/20 0.66
▸ DAPK3 O43293 6/20 0.66
▸ LIMK1 P53667 6/20 0.66
▸ MAPK9 P45984 6/20 0.66

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
SCHEMBL660382 0.84 GSK3A (0.60) ICAM1SELEVCAM1PIM1GSK3A
SCHEMBL30568694 0.81 ICAM1 (0.67) ICAM1SELEVCAM1PIM1GSK3A
SCHEMBL14023789 0.81 ICAM1 (0.67) ICAM1SELEVCAM1PIM1GSK3A
SCHEMBL15518133 0.81 ICAM1 (0.67) ICAM1SELEVCAM1PIM1GSK3A
SCHEMBL742713 0.81 ICAM1 (0.67) ICAM1SELEVCAM1PIM1GSK3A
SCHEMBL7054697 0.81 ICAM1 (1.00) ICAM1SELEVCAM1PIM1GSK3A
SCHEMBL7053792 0.80 GSK3A (1.00) ICAM1SELEVCAM1PIM1GSK3A
SCHEMBL7056141 0.80 ICAM1 (0.65) ICAM1SELEVCAM1PIM1GSK3A
SCHEMBL7050653 0.79 GSK3A (1.00) ICAM1SELEVCAM1PIM1GSK3A
SCHEMBL660155 0.79 CSNK1D (0.63) ICAM1SELEVCAM1PIM1GSK3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116730995-B Hydrazide compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2024-06-25 — — CN disclosed
WO-2024032715-A1 HYDRAZIDE COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF 深圳微芯生物科技股份有限公司 2024-02-15 — — WO disclosed
CN-116730995-A Hydrazide compound, preparation method and application thereof 深圳微芯生物科技股份有限公司 2023-09-12 — — CN disclosed
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