SCHEMBL29570890

SCHEMBL29570890

CCOC(=O)C(F)(F)C(OC)c1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ KMT2A Q03164 3/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HTT P42858 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CES2 O00748 1/20 0.39
▸ ACHE P22303 1/20 0.39
▸ CES1 P23141 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ CASP3 P42574 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
SCHEMBL29570205 0.82 MAPT (0.46) MAPTSMN1; SMN2KMT2ANPSR1MEN1
SCHEMBL23377838 0.81 MAPT (0.45) MAPTSMN1; SMN2KMT2ANPSR1MEN1
SCHEMBL23377841 0.81 MAPT (0.45) MAPTSMN1; SMN2KMT2ANPSR1MEN1
Hydrochloric Acid SCHEMBL28557076 0.79 MAPT (0.44) MAPTSMN1; SMN2KMT2ANPSR1MEN1
Hydrochloric Acid SCHEMBL28557077 0.79 MAPT (0.44) MAPTSMN1; SMN2KMT2ANPSR1MEN1
SCHEMBL29570358 0.78 KCNN4 (0.42) MAPTSMN1; SMN2LMNAHPGDHTT
SCHEMBL29570745 0.75 MAPT (0.45) MAPTSMN1; SMN2KMT2ANPSR1MEN1
SCHEMBL9070698 0.73 MAPT (0.43) MAPTSMN1; SMN2KMT2ANPSR1MEN1
SCHEMBL6487847 0.72 ALDH1A1 (0.50) KMT2ANPSR1HPGDALDH1A1CES2
SCHEMBL12282257 0.71 AOC3 (0.42) MAPTHTTALDH1A1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116802181-A Triazolopyridine compounds as kinase inhibitors 百时美施贵宝公司 2023-09-22 — — CN disclosed
EP-4229056-A1 TRIAZOLOPYRIDINYL COMPOUNDS AS KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2023-08-23 — — EP disclosed
WO-2022086828-A1 TRIAZOLOPYRIDINYL COMPOUNDS AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2022-04-28 — — WO disclosed
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