SCHEMBL23754392

SCHEMBL23754392

O=C(Nc1ccc(F)cc1)c1nc2cccc(-c3cccc(F)c3)n2n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 7/20 0.51
▸ JAK1 P23458 2/20 0.46
▸ EGLN2 Q96KS0 1/20 0.45
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ IDO1 P14902 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ MAPT P10636 2/20 0.43
▸ TYK2 P29597 1/20 0.43
▸ ESRRG P62508 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ ATR Q13535 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41

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 0.91 JAK1 (0.53) JAK2JAK1KMT2AMEN1SMN1; SMN2
SCHEMBL23764040 0.82 JAK1 (0.48) JAK2JAK1EGLN2KMT2ASMN1; SMN2
SCHEMBL23754207 0.81 JAK1 (0.51) JAK2JAK1EGLN2KMT2AMEN1
SCHEMBL23754203 0.81 JAK2 (0.47) JAK2JAK1KMT2AMEN1SMN1; SMN2
SCHEMBL23754239 0.81 SMN1; SMN2 (0.46) JAK1KMT2AMEN1SMN1; SMN2TP53
SCHEMBL23764043 0.76 JAK1 (0.42) JAK2JAK1IDO1SMN1; SMN2TP53
SCHEMBL23764045 0.76 IL2 (0.52) JAK2JAK1IDO1SMN1; SMN2TP53
SCHEMBL23754210 0.76 MAPT (0.46) JAK1KMT2AMEN1SMN1; SMN2TP53
SCHEMBL3200315 0.73 JAK2 (0.66) JAK2JAK1TYK2
SCHEMBL2145155 0.73 JAK2 (0.56) JAK2JAK1

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
Send feedback