SCHEMBL28884126

SCHEMBL28884126

CCOc1ccc(Nc2cc(-c3c(F)cccc3F)nnc2C(N)=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 5/20 0.54
▸ TYK2 P29597 4/20 0.54
▸ JAK1 P23458 3/20 0.54
▸ JAK3 P52333 3/20 0.54
▸ ALDH1A1 P00352 3/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ PKM P14618 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ DHODH Q02127 2/20 0.40
▸ ZAP70 P43403 1/20 0.40
▸ SYK P43405 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL28362708 0.91 DHODH (0.45) JAK2TYK2JAK1JAK3ALDH1A1
SCHEMBL28359239 0.90 JAK2 (0.43) JAK2TYK2JAK1JAK3ALDH1A1
SCHEMBL29922588 0.90 JAK2 (0.43) JAK2TYK2JAK1JAK3ALDH1A1
SCHEMBL29551888 0.83 JAK2 (0.59) JAK2TYK2JAK1JAK3MAPT
SCHEMBL28359205 0.82 JAK2 (0.56) JAK2TYK2JAK1JAK3DHODH
SCHEMBL29552249 0.81 TYK2 (0.58) JAK2TYK2JAK1JAK3MEN1
SCHEMBL28359236 0.81 TYK2 (0.58) JAK2TYK2JAK1JAK3MEN1
SCHEMBL28884120 0.81 TYK2 (0.55) JAK2TYK2JAK1JAK3MAPT
SCHEMBL28362706 0.81 JAK2 (0.55) JAK2TYK2JAK1JAK3
SCHEMBL28363100 0.81 JAK2 (0.57) JAK2TYK2JAK1JAK3DHODH

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-110818641-B Pyridazine-3-formamide compound, preparation method and application thereof in medicine and pharmacology 北京诺诚健华医药科技有限公司 2022-10-14 — — CN disclosed
WO-2022032484-A1 PYRIDAZINE-3-FORMAMIDE COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 北京诺诚健华医药科技有限公司 2022-02-17 — — WO disclosed
CN-110818641-A Pyridazine-3-formamide compound, preparation method and application thereof in medicine and pharmacology 北京诺诚健华医药科技有限公司 2020-02-21 — — CN disclosed
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