SCHEMBL32679646

SCHEMBL32679646

CCOC(=O)c1cnc(N2CCC3(CC2)CN(C(=O)OCc2ccccc2)C3)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.48
ATXN2 Q99700 2/20 0.48
ACACB O00763 1/20 0.48
HDAC1 Q13547 3/20 0.44
HDAC3 O15379 2/20 0.44
HDAC2 Q92769 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
P2RY12 Q9H244 5/20 0.42
ALDH1A1 P00352 4/20 0.42
CYP3A4 P08684 3/20 0.42
CYP2C9 P11712 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
MAPK1 P28482 2/20 0.41
OGA O60502 1/20 0.41
PTPN11 Q06124 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41

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
SCHEMBL28597527 0.95 ACACB (0.54) ENPP2ATXN2ACACBHDAC1HDAC3
SCHEMBL28603043 0.84 ACACB (0.53) ENPP2ATXN2ACACBHDAC1HDAC3
SCHEMBL32679621 0.82 ACACB (0.46) ACACBOGANPSR1HSD17B10TSHR
SCHEMBL1639864 0.80 KMT2A (0.56) ENPP2ATXN2ACACBHDAC1HDAC3
SCHEMBL15344305 0.78 HDAC1 (0.54) HDAC1HDAC3HDAC2HDAC6CYP3A4
SCHEMBL28614518 0.77 CYP11B2 (0.51) ACACBCYP3A4OGANPSR1MAPT
SCHEMBL19633325 0.76 ENPP2 (0.53) ENPP2ATXN2ACACBALDH1A1CYP3A4
SCHEMBL25376016 0.76 ENPP2 (0.55) ENPP2ATXN2ACACBCYP3A4CYP2C19
SCHEMBL1618023 0.76 PRMT1 (0.61) HDAC1HDAC3HDAC2HDAC6P2RY12
SCHEMBL16651754 0.76 HDAC1 (0.56) HDAC1HDAC3HDAC2HDAC6CYP3A4

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-121574128-A Pyrimidine-hydroxamic acid compounds and uses thereof 华东理工大学 2026-02-27 CN disclosed