SCHEMBL22245656

SCHEMBL22245656

Cc1nccc(C(=O)N/C(=N/N)N(C)N)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
MTOR P42345 3/20 0.32
CCNE1 P24864 1/20 0.32
CDK2 P24941 1/20 0.32
ADORA2A P29274 1/20 0.32
PIK3CA P42336 1/20 0.31

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
SCHEMBL23913889 0.90 SLC6A9 (0.34) P2RX7L3MBTL1
SCHEMBL22245632 0.82 KDM4E (0.30)
SCHEMBL23914139 0.81 CDK2 (0.33) CDK2
SCHEMBL22918688 0.75 CTSS (0.35)
SCHEMBL23913851 0.72 MAPK14 (0.33) CDK2
SCHEMBL8098266 0.68 SMN1; SMN2 (0.46) L3MBTL1
SCHEMBL23500690 0.67 ATR (0.48) L3MBTL1
SCHEMBL22245544 0.66 NPC1 (0.46) L3MBTL1
SCHEMBL22918431 0.64 ALDH1A1 (0.32)
SCHEMBL22245654 0.62 POLB (0.61) L3MBTL1

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
WO-2020147705-A1 4-PYRIDINYL FORMAMIDE COMPOUND OR DERIVATIVE THEREOF, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF 青岛清原化合物有限公司 2020-07-23 WO disclosed