SCHEMBL23754203

SCHEMBL23754203

O=C(Nc1ccc(F)cc1)c1nc2cccc(-c3ccc(OC(F)(F)F)cc3)n2n1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 3/20 0.47
▸ ABL1 P00519 5/20 0.47
▸ JAK1 P23458 4/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ HTT P42858 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ MAPT P10636 2/20 0.43
▸ TYK2 P29597 1/20 0.43
▸ SCN10A Q9Y5Y9 1/20 0.42
▸ TRPV1 Q8NER1 1/20 0.42

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 0.85 JAK1 (0.53) JAK2JAK1SMN1; SMN2MEN1KMT2A
SCHEMBL23764043 0.84 JAK1 (0.42) JAK2ABL1JAK1SMN1; SMN2HTT
SCHEMBL23764040 0.81 JAK1 (0.48) JAK2JAK1SMN1; SMN2KMT2ATP53
SCHEMBL23754392 0.81 JAK2 (0.51) JAK2JAK1SMN1; SMN2MEN1KMT2A
SCHEMBL23754207 0.76 JAK1 (0.51) JAK2JAK1SMN1; SMN2MEN1KMT2A
SCHEMBL23754239 0.76 SMN1; SMN2 (0.46) JAK1SMN1; SMN2MEN1KMT2ATP53
SCHEMBL3193345 0.73 JAK2 (0.76) JAK2JAK1
SCHEMBL23764045 0.73 IL2 (0.52) JAK2JAK1SMN1; SMN2TP53TYK2
SCHEMBL3215657 0.73 JAK2 (0.63) JAK2ABL1JAK1
SCHEMBL23754210 0.73 MAPT (0.46) JAK1SMN1; SMN2MEN1KMT2ATP53

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
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
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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