SCHEMBL29844244

SCHEMBL29844244

CNc1nc(C)nc(Cl)c1CO

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 3/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ PDK4 Q16654 1/20 0.30
▸ YTHDC1 Q96MU7 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
SCHEMBL27186297 1.00 PDK2 (0.32) PDK2KDM4EMEN1KMT2ALMNA
SCHEMBL2179135 0.85 PDK2 (0.32) PDK2
SCHEMBL30853310 0.82 LMNA (0.31) PDK2LMNAHTTSMN1; SMN2PDK4
SCHEMBL27186160 0.82 LMNA (0.31) PDK2LMNAHTTSMN1; SMN2PDK4
SCHEMBL20840567 0.81 KDM4E (0.34) PDK2KDM4EMEN1KMT2A
SCHEMBL31365128 0.73 LMNA (0.38) KDM4EMEN1KMT2ALMNA
SCHEMBL22139940 0.73 LMNA (0.38) KDM4EMEN1KMT2ALMNA
SCHEMBL12303154 0.73 PDK2 (0.36) PDK2PDK4YTHDC1
SCHEMBL24671925 0.69 YTHDC1 (0.32) PDK2YTHDC1
SCHEMBL23326569 0.69 LRRK2 (0.32) PDK2YTHDC1

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-117651701-A Novel substituted bicyclic aza heterocycles as SOS1 inhibitors 唯久生物技术(苏州)有限公司 2024-03-05 — — CN disclosed
WO-2022187266-A1 NOVEL SUBSTITUTED BICYCLI AZA-HETEROCYCLES AS SOS1 INHIBITORS VIVA STAR BIOSCIENCES (SUZHOU) CO., LTD. (CN) 2022-09-09 — — WO disclosed
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