SCHEMBL26869154

SCHEMBL26869154

C=CC(C)(C)c1cc(NC)n2ncc(C)c2n1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.34
▸ MAPT P10636 3/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ ATM Q13315 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ CDK2 P24941 1/20 0.34
▸ TYK2 P29597 3/20 0.33
▸ GSK3B P49841 1/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ GFER P55789 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ IKBKB O14920 1/20 0.30
▸ CHUK O15111 1/20 0.30
▸ PDE4D Q08499 1/20 0.30

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
SCHEMBL26871792 0.83 CSNK2B (0.46) KDM4EMAPTNPC1RAB9AATM
SCHEMBL26870979 0.81 KDM4E (0.36) KDM4EMAPTRAB9A
SCHEMBL26869184 0.81 KDM4E (0.36) KDM4EMAPTNPC1RAB9ACDK2
SCHEMBL26871796 0.78 CDK9 (0.48) CDK2
SCHEMBL26868079 0.77 TYK2 (0.36) KDM4EMAPTNPC1RAB9AATM
SCHEMBL26253982 0.75 TYK2 (0.45) KDM4EMAPTNPC1RAB9AL3MBTL1
SCHEMBL23772369 0.72 CDK2 (0.46) KDM4EMAPTRAB9ACDK2TYK2
SCHEMBL26873603 0.69 CSNK2B (0.46) KDM4EMAPTNPC1RAB9AATM
SCHEMBL26871218 0.68 KDM4E (0.34) KDM4EMAPTRAB9ACDK2
SCHEMBL26871243 0.66 KDM4E (0.33) KDM4EMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4282868-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE-7-AMINE DERIVATIVE, AND COMPOSITIONS AND MEDICAL USE THEREOF Shanghai Haiyan Pharmaceutical Technology Co., Ltd (CN) 2023-11-29 — — EP disclosed
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