SCHEMBL30148282

SCHEMBL30148282

CN(c1ccc(N)c(C(N)=O)n1)[C@H]1CCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 5/20 0.47
GPR119 Q8TDV5 9/20 0.45
PRMT5 O14744 1/20 0.44
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
BTK Q06187 1/20 0.41
PARP1 P09874 1/20 0.40

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
SCHEMBL23537599 1.00 USP30 (0.47) USP30GPR119PRMT5JAK2JAK1
SCHEMBL23537598 1.00 USP30 (0.47) USP30GPR119PRMT5JAK2JAK1
SCHEMBL594396 0.80 GPR119 (0.52) USP30GPR119PRMT5JAK2JAK1
SCHEMBL594397 0.80 GPR119 (0.52) USP30GPR119PRMT5JAK2JAK1
SCHEMBL28834341 0.79 USP30 (0.53) USP30GPR119PRMT5JAK2JAK1
SCHEMBL28834338 0.79 USP30 (0.53) USP30GPR119PRMT5JAK2JAK1
SCHEMBL15178743 0.78 GPR119 (0.54) USP30GPR119PRMT5JAK2JAK1
SCHEMBL24628228 0.76 USP30 (0.57) USP30GPR119JAK2JAK1HDAC1
SCHEMBL17837770 0.76 GPR119 (0.51) GPR119PRMT5
SCHEMBL671286 0.76 JAK2 (0.49) USP30GPR119PRMT5JAK2

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
WO-2022266427-A1 4-(ARYL-METHYL-AMINO)-QUINAZOLINE DERIVATIVES AND USES THEREOF BLACK DIAMOND THERAPEUTICS, INC. (US) 2022-12-22 WO disclosed