SCHEMBL26394010

SCHEMBL26394010

CC(C)(C)c1ccc(Cl)c(-c2ccc3[nH]nc(NC=O)c3c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 3/20 0.40
▸ JAK1 P23458 1/20 0.40
▸ TYK2 P29597 1/20 0.40
▸ JAK3 P52333 1/20 0.40
▸ HDAC6 Q9UBN7 2/20 0.39
▸ PAK1 Q13153 1/20 0.39
▸ PRKAA1 Q13131 4/20 0.38
▸ PRKAB2 O43741 3/20 0.38
▸ PRKAG1 P54619 3/20 0.38
▸ PRKAA2 P54646 3/20 0.38
▸ PRKAG3 Q9UGI9 3/20 0.38
▸ PRKAG2 Q9UGJ0 3/20 0.38
▸ PRKAB1 Q9Y478 3/20 0.38
▸ GSK3B P49841 9/20 0.38
▸ CYP1A2 P05177 3/20 0.36
▸ MAP3K8 P41279 1/20 0.36
▸ PLK4 O00444 1/20 0.35
▸ MAPK13 O15264 1/20 0.35
▸ DAPK3 O43293 1/20 0.35
▸ PRKD3 O94806 1/20 0.35

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
SCHEMBL26394024 0.83 GSK3B (0.44) JAK2JAK1TYK2JAK3HDAC6
SCHEMBL26393862 0.83 GSK3B (0.45) JAK2JAK1TYK2JAK3HDAC6
SCHEMBL26393577 0.82 FADS1 (0.47) JAK2JAK1TYK2JAK3HDAC6
SCHEMBL26393960 0.82 JAK2 (0.40) JAK2JAK1TYK2JAK3HDAC6
SCHEMBL26393770 0.81 PRKAA1 (0.47) JAK2JAK1TYK2JAK3HDAC6
SCHEMBL26393947 0.81 JAK2 (0.61) JAK2JAK1TYK2JAK3HDAC6
SCHEMBL26397024 0.81 LRRK2 (0.41) JAK2JAK1TYK2JAK3HDAC6
SCHEMBL26393744 0.80 MAP2K4 (0.46) JAK2JAK1TYK2JAK3HDAC6
SCHEMBL26393411 0.78 GSK3B (0.45) JAK2JAK1TYK2JAK3PAK1
SCHEMBL26393501 0.78 JAK2 (0.44) JAK2JAK1TYK2JAK3HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023186773-A1 SUBSTITUTED 3-AMINO INDAZOLE DERIVATIVES AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2023-10-05 — — WO disclosed
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