SCHEMBL31634751

SCHEMBL31634751

COCCCCOC(=O)C1=C(C)NC2=C(C(=O)CC(c3ccccc3OC)C2)C1c1cccc(O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.51
HSD17B10 Q99714 7/20 0.51
ALDH1A1 P00352 7/20 0.51
HPGD P15428 6/20 0.51
CASP1 P29466 5/20 0.51
CASP7 P55210 5/20 0.51
LMNA P02545 3/20 0.51
BAP1 Q92560 1/20 0.47
USP2 O75604 2/20 0.47
MAPK1 P28482 1/20 0.47
RAB9A P51151 1/20 0.47
POLB P06746 5/20 0.47
GAA P10253 5/20 0.47
TP53 P04637 2/20 0.46
AGTR1 P30556 1/20 0.46
TSHR P16473 1/20 0.43
GLA P06280 1/20 0.43
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KMT2A Q03164 1/20 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
SCHEMBL30938378 1.00 KDM4E (0.51) KDM4EHSD17B10ALDH1A1HPGDCASP1
SCHEMBL30938395 1.00 KDM4E (0.51) KDM4EHSD17B10ALDH1A1HPGDCASP1
SCHEMBL31634735 1.00 KDM4E (0.51) KDM4EHSD17B10ALDH1A1HPGDCASP1
SCHEMBL644336 0.95 KDM4E (0.54) KDM4EHSD17B10ALDH1A1HPGDCASP1
SCHEMBL30195593 0.95 KDM4E (0.54) KDM4EHSD17B10ALDH1A1HPGDCASP1
SCHEMBL29392482 0.95 KDM4E (0.54) KDM4EHSD17B10ALDH1A1HPGDCASP1
SCHEMBL31634746 0.94 KDM4E (0.55) KDM4EHSD17B10ALDH1A1HPGDCASP1
SCHEMBL30938399 0.94 KDM4E (0.55) KDM4EHSD17B10ALDH1A1HPGDCASP1
SCHEMBL30938448 0.94 KDM4E (0.55) KDM4EHSD17B10ALDH1A1HPGDCASP1
SCHEMBL30938465 0.92 KDM4E (0.47) KDM4EHSD17B10ALDH1A1HPGDCASP1

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-120202189-A Immunosuppressant compounds 巴塞尔大学 2025-06-24 CN claimed
CN-120202189-A Immunosuppressant compounds 巴塞尔大学 2025-06-24 CN disclosed