SCHEMBL23764040

SCHEMBL23764040

C=Cc1ccc(-c2cccc3nc(C(=O)Nc4ccc(F)cc4)nn23)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 9/20 0.48
▸ TYK2 P29597 1/20 0.44
▸ JAK2 O60674 5/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ PTPN1 P18031 1/20 0.39
▸ EGLN2 Q96KS0 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
SCHEMBL23753737 0.87 JAK1 (0.53) JAK1TYK2JAK2SMN1; SMN2TP53
SCHEMBL23754392 0.82 JAK2 (0.51) JAK1TYK2JAK2SMN1; SMN2TP53
SCHEMBL23754203 0.81 JAK2 (0.47) JAK1TYK2JAK2SMN1; SMN2TP53
SCHEMBL23754207 0.78 JAK1 (0.51) JAK1TYK2JAK2SMN1; SMN2TP53
SCHEMBL23754239 0.77 SMN1; SMN2 (0.46) JAK1SMN1; SMN2TP53MAPTNPC1
SCHEMBL23764043 0.73 JAK1 (0.42) JAK1JAK2SMN1; SMN2TP53MAPT
SCHEMBL23754210 0.72 MAPT (0.46) JAK1SMN1; SMN2TP53MAPTNPC1
SCHEMBL23764045 0.71 IL2 (0.52) JAK1TYK2JAK2SMN1; SMN2TP53
SCHEMBL2250300 0.66 NUDT1 (0.73) JAK1TYK2JAK2TP53NPC1
SCHEMBL2252969 0.66 EGLN2 (0.54) JAK1TYK2JAK2NPC1EGLN2

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-2021161084-A1 N-(4-FLUOROPHENYL)-5-PHENYL-[1,2,4] TRIAZOLO [1,5-A] PYRIDINE-2-CARBOXAMIDE DERIVATIVES AND THEIR SYNTHESIS THEREOF NINGEGOWDA RAGHU (IN) 2021-08-19 — — WO disclosed
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