SCHEMBL29059152

SCHEMBL29059152

Cc1cccc2c(=O)n(C)nc(N)c12

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 8/20 0.47
HPGD P15428 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 2/20 0.40
CDK8 P49336 1/20 0.40
ACVR1 Q04771 1/20 0.40
GAA P10253 1/20 0.39

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
SCHEMBL17559093 0.80 KAT2B (0.47) KAT2BHPGDSMN1; SMN2LMNA
SCHEMBL8535608 0.77 HPGD (0.47) KAT2BHPGDSMN1; SMN2CDK8ACVR1
SCHEMBL590272 0.75 KDR (0.43) LMNA
SCHEMBL19377004 0.73 KAT2B (0.47) KAT2BHPGDSMN1; SMN2GAA
SCHEMBL16006573 0.72 ALKBH5 (0.43) HPGDLMNA
SCHEMBL17571754 0.70 KAT2B (0.44) KAT2BHPGDLMNA
SCHEMBL18436503 0.68 BRD4 (0.61)
SCHEMBL19533290 0.68 CDK8 (0.34) HPGDCDK8ACVR1
SCHEMBL16158053 0.67 MAPT (0.36) LMNAGAA
SCHEMBL434996 0.67 NPSR1 (0.58) HPGDSMN1; SMN2LMNACDK8ACVR1

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
CN-116635371-A Polycyclic pyridazinone derivative serving as SOS1 inhibitor, and preparation method and application thereof 苏州阿尔脉生物科技有限公司 2023-08-22 CN disclosed