SCHEMBL29551791

SCHEMBL29551791

COC(=O)c1nnc(Cl)cc1Nc1ccc(C(C)(C)C(=O)OC(C)(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 2/20 0.41
▸ KMT2A Q03164 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ AKR1C3 P42330 1/20 0.34
▸ AKR1C2 P52895 1/20 0.34
▸ ATR Q13535 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ RORC P51449 1/20 0.33
▸ MAPT P10636 3/20 0.32
▸ RAF1 P04049 3/20 0.32
▸ MAPK14 Q16539 2/20 0.32
▸ MITF O75030 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ BTK Q06187 1/20 0.32
▸ PDE4B Q07343 1/20 0.32
▸ PDE4D Q08499 1/20 0.32
▸ TRPV1 Q8NER1 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPK1 P28482 1/20 0.32

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
SCHEMBL28359014 1.00 SYK (0.41) SYKKMT2ALMNAAKR1C3AKR1C2
SCHEMBL28362546 0.85 SYK (0.43) SYKKMT2ALMNAKDM4EMAPT
SCHEMBL29922602 0.85 SYK (0.43) SYKKMT2ALMNAKDM4EMAPT
SCHEMBL29922807 0.81 SYK (0.40) SYKKMT2ALMNAMAPT
SCHEMBL28359228 0.81 SYK (0.40) SYKKMT2ALMNAMAPT
SCHEMBL28362586 0.81 JAK2 (0.42) —
SCHEMBL29922686 0.81 JAK2 (0.42) —
SCHEMBL15091096 0.80 SYK (0.56) SYKKMT2ALMNAAKR1C3AKR1C2
SCHEMBL29922815 0.79 SYK (0.40) SYKKMT2ALMNAATRMAPT
SCHEMBL28359212 0.79 SYK (0.40) SYKKMT2ALMNAATRMAPT

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
Send feedback