SCHEMBL29150579

SCHEMBL29150579

Brc1cc(C2CCOCC2)ncn1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 1/20 0.37
▸ KMO O15229 1/20 0.37
▸ PIK3CD O00329 2/20 0.35
▸ PIK3CA P42336 1/20 0.35
▸ CHRM4 P08173 1/20 0.33
▸ DAO P14920 1/20 0.33
▸ CSF1R P07333 1/20 0.32
▸ HTR6 P50406 1/20 0.31
▸ MAPK1 P28482 2/20 0.31
▸ RET P07949 2/20 0.30
▸ MAP3K12 Q12852 1/20 0.30
▸ BRD4 O60885 1/20 0.30
▸ CREBBP Q92793 1/20 0.30
▸ LRRK2 Q5S007 1/20 0.30
▸ PDE1B Q01064 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
SCHEMBL15446373 0.86 KMO (0.42) KMO
SCHEMBL25147466 0.78 PIK3CD (0.41) KDM5BKMOPIK3CDPIK3CACHRM4
SCHEMBL2595624 0.78 KMO (0.40) KDM5BKMOPIK3CDPIK3CACHRM4
SCHEMBL23025135 0.78 RET (0.38) KDM5BKMOPIK3CDPIK3CACSF1R
SCHEMBL25147385 0.74 KDM5B (0.35) KDM5BKMOPIK3CDPIK3CACHRM4
SCHEMBL16692772 0.73 PIK3CD (0.43) KDM5BPIK3CDPIK3CAMAPK1MAP3K12
SCHEMBL29979598 0.73 PIK3CD (0.43) KDM5BPIK3CDPIK3CAMAPK1MAP3K12
SCHEMBL31705056 0.73 KMO (0.71) KMO
Lithium Ion SCHEMBL31704699 0.70 KMO (0.51) KDM5BKMOPIK3CDPIK3CADAO
SCHEMBL16441792 0.70 KMO (0.48) KMORETLRRK2

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-117295737-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2023-12-26 — — CN disclosed
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