SCHEMBL29538200

SCHEMBL29538200

Nc1nc2ccc(-c3cnc4[nH]ccc4c3)cn2c1C(=O)C1CCNC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 3/20 0.45
▸ RIPK1 Q13546 3/20 0.43
▸ ABL1 P00519 2/20 0.42
▸ MAP4K1 Q92918 1/20 0.41
▸ CDK8 P49336 6/20 0.40
▸ CDK7 P50613 2/20 0.40
▸ CCNT1 O60563 1/20 0.40
▸ CCND1 P24385 1/20 0.40
▸ CCNC P24863 1/20 0.40
▸ CDK9 P50750 1/20 0.40
▸ CCNH P51946 1/20 0.40
▸ MNAT1 P51948 1/20 0.40
▸ CDK6 Q00534 1/20 0.40
▸ MAP4K4 O95819 3/20 0.38
▸ MARK3 P27448 3/20 0.38
▸ KDR P35968 3/20 0.38
▸ CLK2 P49760 3/20 0.38
▸ ROCK1 Q13464 3/20 0.38
▸ CLK4 Q9HAZ1 3/20 0.38
▸ MAP4K5 Q9Y4K4 3/20 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
SCHEMBL24285969 1.00 LRRK2 (0.45) LRRK2RIPK1ABL1MAP4K1CDK8
SCHEMBL24285848 0.94 LRRK2 (0.47) LRRK2RIPK1ABL1MAP4K1CDK8
SCHEMBL29537003 0.94 LRRK2 (0.47) LRRK2RIPK1ABL1MAP4K1CDK8
SCHEMBL29537535 0.84 JAK1 (0.36) ABL1PIK3CAJAK2
SCHEMBL24285931 0.84 JAK1 (0.34) CDK8CCNCROCK2PAK4CDK2
SCHEMBL29537272 0.84 JAK1 (0.34) CDK8CCNCROCK2PAK4CDK2
SCHEMBL24285879 0.84 JAK1 (0.36) ABL1PIK3CAJAK2
SCHEMBL24285977 0.83 LRRK2 (0.59) LRRK2RIPK1ABL1MAP4K1CDK8
SCHEMBL29537401 0.83 LRRK2 (0.59) LRRK2RIPK1ABL1MAP4K1CDK8
SCHEMBL24285984 0.78 RIPK1 (0.47) LRRK2RIPK1MAP4K1CDK8CDK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4214207-A1 2-AMINO-3-CARBONYL IMIDAZOPYRIDINE AND PYRAZOLOPYRIDINE COMPOUNDS 1st Biotherapeutics, Inc. (KR) 2023-07-26 — — EP claimed
CN-116457355-A 2-amino-3-carbonyl imidazopyridines and pyrazolopyridines compounds 第一生物治疗股份有限公司 2023-07-18 — — CN claimed
WO-2022058890-A1 2-AMINO-3-CARBONYL IMIDAZOPYRIDINE AND PYRAZOLOPYRIDINE COMPOUNDS 1ST Biotherapeutics, Inc. (KR) 2022-03-24 — — WO claimed
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