SCHEMBL28362944

SCHEMBL28362944

Cc1c(-c2c(F)cccc2Cl)nnc(C(=O)O)c1Nc1ccc(S(=O)(=O)N2CCN(C3CC3)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 6/20 0.41
▸ ALDH1A1 P00352 5/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CCNB2 O95067 1/20 0.41
▸ CDK1 P06493 1/20 0.41
▸ CCNB1 P14635 1/20 0.41
▸ CCNB3 Q8WWL7 1/20 0.41
▸ GAA P10253 3/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ KDM4E B2RXH2 4/20 0.39
▸ TRPV4 Q9HBA0 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ ATM Q13315 1/20 0.38
▸ POLB P06746 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
SCHEMBL29552550 0.82 JAK2 (0.53) SMN1; SMN2ALDH1A1LMNACCNB2CDK1
SCHEMBL29552194 0.78 TYK2 (0.51) SMN1; SMN2ALDH1A1LMNAGAAMAPT
SCHEMBL28362942 0.78 TYK2 (0.51) SMN1; SMN2ALDH1A1LMNAGAAMAPT
Hydrochloric Acid SCHEMBL29922656 0.77 JAK2 (0.42) SMN1; SMN2ALDH1A1LMNACCNB2CDK1
SCHEMBL28362751 0.77 JAK2 (0.62) SMN1; SMN2ALDH1A1LMNACCNB2CDK1
Hydrochloric Acid SCHEMBL28855229 0.76 JAK2 (0.62) SMN1; SMN2ALDH1A1LMNACCNB2CDK1
SCHEMBL29552289 0.64 JAK2 (0.54) CCNB2CDK1CCNB1CCNB3MAPT
SCHEMBL29552225 0.63 JAK2 (0.45) ALDH1A1GAAMAPTNPC1
SCHEMBL31388289 0.62 SMN1; SMN2 (0.77) SMN1; SMN2ALDH1A1LMNAGAAHTT
SCHEMBL31388283 0.62 ALDH1A1 (0.84) SMN1; SMN2ALDH1A1LMNAGAAPKM

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
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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