SCHEMBL23754239

SCHEMBL23754239

O=C(Nc1ccc(F)cc1)c1nc2cccc(Br)n2n1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ TP53 P04637 1/20 0.46
▸ MAPT P10636 2/20 0.46
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ LMNA P02545 2/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ JAK1 P23458 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ RIPK1 Q13546 1/20 0.40
▸ PTPN1 P18031 1/20 0.39
▸ POLB P06746 2/20 0.39
▸ AHR P35869 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39

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 0.82 JAK1 (0.53) SMN1; SMN2TP53MAPTMEN1KMT2A
SCHEMBL23754207 0.81 JAK1 (0.51) SMN1; SMN2TP53MAPTMEN1KMT2A
SCHEMBL23754392 0.81 JAK2 (0.51) SMN1; SMN2TP53MAPTMEN1KMT2A
SCHEMBL23764040 0.77 JAK1 (0.48) SMN1; SMN2TP53MAPTKMT2ANPC1
SCHEMBL23764043 0.76 JAK1 (0.42) SMN1; SMN2TP53MAPTLMNAJAK1
SCHEMBL23754203 0.76 JAK2 (0.47) SMN1; SMN2TP53MAPTMEN1KMT2A
SCHEMBL23754210 0.75 MAPT (0.46) SMN1; SMN2TP53MAPTMEN1KMT2A
SCHEMBL18341116 0.74 AHR (0.49) SMN1; SMN2MEN1KMT2AJAK1KDM4E
SCHEMBL23764045 0.73 IL2 (0.52) SMN1; SMN2TP53JAK1
SCHEMBL28485655 0.73 AHR (0.47) KDM4EALDH1A1AHR

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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