SCHEMBL30207451

SCHEMBL30207451

CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ccc(N)cc2F)CC1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 1/20 0.58
PTPN1 P18031 1/20 0.58
PTPN6 P29350 1/20 0.58
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
ABL1 P00519 1/20 0.51
RIN1 Q13671 1/20 0.51
TP53 P04637 1/20 0.49
USP30 Q70CQ3 1/20 0.48
KMT2A Q03164 3/20 0.48
POLB P06746 1/20 0.48
HDAC1 Q13547 2/20 0.48
HDAC2 Q92769 2/20 0.48
STS P08842 5/20 0.47
HDAC3 O15379 1/20 0.47
GPR119 Q8TDV5 1/20 0.47
NR1H2 P55055 1/20 0.46

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
SCHEMBL23783189 1.00 PTPN2 (0.58) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL30738809 0.95 PTPN2 (0.52) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL19617379 0.89 TP53 (0.63) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL3512756 0.86 ALDH1A1 (0.55) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL13060443 0.84 PTPN2 (0.62) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL23783425 0.83 PTPN2 (0.54) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL30207453 0.83 PTPN2 (0.54) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL14447471 0.81 PTPN2 (0.62) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL21392497 0.81 PTPN2 (0.56) PTPN2PTPN1PTPN6NPC1RAB9A
SCHEMBL3171133 0.80 PTPN2 (0.58) PTPN2PTPN1PTPN6NPC1RAB9A

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
EP-4114392-A1 COMPOUNDS FOR TARGETED DEGRADATION OF BRD9 C4 Therapeutics, Inc. (US) 2023-01-11 EP disclosed