SCHEMBL24745829

SCHEMBL24745829

COCCOC1CN(c2ccc(N)nc2)C1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 5/20 0.45
MTOR P42345 5/20 0.45
CHRNB2 P17787 1/20 0.37
CHRNA4 P43681 1/20 0.37
TRPC6 Q9Y210 5/20 0.36
ACACB O00763 2/20 0.34
RET P07949 1/20 0.34
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33

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
SCHEMBL24746474 0.84 CHRNB2 (0.38) PIK3CAMTORCHRNB2CHRNA4ACACB
SCHEMBL14913101 0.82 CHRNB2 (0.42) PIK3CAMTORCHRNB2CHRNA4TRPC6
SCHEMBL7039004 0.81 MAPT (0.40) PIK3CAMTORACACB
SCHEMBL25558377 0.76 CHRNB2 (0.42) CHRNB2CHRNA4TRPC6CHRNB4CHRNA3
SCHEMBL24177865 0.75 CHRNB2 (0.40) CHRNB2CHRNA4TRPC6ACACBCHRNB4
SCHEMBL2792128 0.75 PIK3CA (0.49) PIK3CAMTORCHRNB2CHRNA4CHRNB4
SCHEMBL7035423 0.75 RAD52 (0.47) PIK3CAMTORACACBRET
SCHEMBL1393583 0.74 MAPT (0.49) PIK3CAMTORCHRNB2CHRNA4CHRNB4
SCHEMBL22441718 0.73 PIK3CA (0.56) PIK3CAMTORTRPC6
SCHEMBL17796563 0.73 MAP4K4 (0.50) PIK3CAMTORCHRNB2CHRNA4TRPC6

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-117120090-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2023-11-24 CN disclosed
WO-2022174253-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2022-08-18 WO disclosed