SCHEMBL29552194

SCHEMBL29552194

COC(=O)c1nnc(-c2c(F)cccc2Cl)cc1Nc1ccc(S(=O)(=O)N2CCN(C3CC3)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 2/20 0.51
▸ JAK2 O60674 1/20 0.51
▸ JAK1 P23458 1/20 0.51
▸ JAK3 P52333 1/20 0.51
▸ PKM P14618 3/20 0.42
▸ ALDH1A1 P00352 8/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ LMNA P02545 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ POLB P06746 1/20 0.38
▸ CCNT1 O60563 1/20 0.38
▸ CDK4 P11802 1/20 0.38
▸ CCND1 P24385 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
SCHEMBL28362942 1.00 TYK2 (0.51) TYK2JAK2JAK1JAK3PKM
SCHEMBL29552550 0.92 JAK2 (0.53) TYK2JAK2JAK1JAK3PKM
SCHEMBL28362751 0.91 JAK2 (0.62) TYK2JAK2JAK1JAK3PKM
Hydrochloric Acid SCHEMBL28855229 0.91 JAK2 (0.62) TYK2JAK2JAK1JAK3PKM
SCHEMBL28359048 0.84 TYK2 (0.55) TYK2JAK2JAK1JAK3ALDH1A1
SCHEMBL29551775 0.84 TYK2 (0.55) TYK2JAK2JAK1JAK3ALDH1A1
SCHEMBL29552137 0.83 JAK2 (0.54) TYK2JAK2JAK1JAK3ALDH1A1
SCHEMBL28359246 0.83 JAK2 (0.54) TYK2JAK2JAK1JAK3ALDH1A1
SCHEMBL29922746 0.78 TYK2 (0.81) TYK2JAK2JAK1JAK3ALDH1A1
SCHEMBL29922630 0.78 TYK2 (0.54) TYK2JAK2JAK1JAK3ALDH1A1

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
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
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