SCHEMBL29217192

SCHEMBL29217192

CN(C)CCn1cc(OB(O)O)cn1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 1/20 0.36
▸ BRD4 O60885 1/20 0.32
▸ CREBBP Q92793 1/20 0.32
▸ JAK1 P23458 2/20 0.32
▸ JAK3 P52333 2/20 0.32
▸ JAK2 O60674 1/20 0.32
▸ TYK2 P29597 1/20 0.32
▸ FLT3 P36888 3/20 0.31
▸ TLR7 Q9NYK1 2/20 0.31
▸ NEK2 P51955 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ ALOX5AP P20292 1/20 0.31
▸ TGFBR1 P36897 1/20 0.31
▸ CHRNB2 P17787 1/20 0.30
▸ CHRNA4 P43681 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
SCHEMBL31128947 0.78 KMT2A (0.35) FLT3L3MBTL1
SCHEMBL15330085 0.76 BRD4 (0.34) BRD4CREBBPJAK1JAK3JAK2
SCHEMBL31128801 0.75 ABL1 (0.36) ABL1JAK1JAK3JAK2TYK2
SCHEMBL31128872 0.74 CHRNB2 (0.33) JAK1JAK3JAK2TYK2FLT3
SCHEMBL29217173 0.73 FFAR1 (0.46) ABL1JAK1JAK3JAK2TYK2
SCHEMBL553466 0.73 ALDH1A1 (0.41) JAK1JAK3JAK2TYK2L3MBTL1
SCHEMBL3491600 0.72 KDM4C (0.33) BRD4L3MBTL1
SCHEMBL29267533 0.72 GAA (0.32) —
SCHEMBL31128893 0.72 ABL1 (0.39) ABL1JAK1JAK3JAK2TYK2
SCHEMBL31128903 0.71 ABL1 (0.34) ABL1

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-118084892-A Compounds useful as HPK1 inhibitors 深圳福沃药业有限公司 2024-05-28 — — CN disclosed
CN-117946093-A Compounds useful as HPK1 inhibitors 深圳福沃药业有限公司 2024-04-30 — — CN disclosed
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