SCHEMBL30926528

SCHEMBL30926528

CC(C)(C)OC(=O)N1CCC(c2nsc(N)n2)CC1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.46
GPR119 Q8TDV5 10/20 0.43
PTPN2 P17706 1/20 0.43
PTPN1 P18031 1/20 0.43
PTPN6 P29350 1/20 0.43
HPGD P15428 1/20 0.43
NAMPT P43490 1/20 0.42
RECQL P46063 1/20 0.41
EPHX1 P07099 1/20 0.41
HTT P42858 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
SCHEMBL30926348 0.88 ALDH1A1 (0.44) KDM4EMAPTHPGDRECQL
SCHEMBL23148885 0.87 KDM4E (0.40) KDM4EGPR119HPGDEPHX1
SCHEMBL14829908 0.77 KDM4E (0.49) KDM4EMAPTTHRBGPR119HPGD
SCHEMBL4477598 0.77 KDM4E (0.52) KDM4EMAPTTHRBGPR119PTPN2
SCHEMBL30926233 0.76 PTPN11 (0.50) MAPTGPR119
SCHEMBL23459591 0.76 GPR119 (0.57) KDM4EMAPTTHRBGPR119PTPN2
SCHEMBL31665288 0.76 KDM4E (0.45) KDM4EMAPTTHRBGPR119HPGD
SCHEMBL3060679 0.76 KDM4E (0.48) KDM4EMAPTTHRBGPR119HPGD
SCHEMBL26450489 0.75 GPR119 (0.53) KDM4EMAPTTHRBGPR119PTPN2
SCHEMBL3897024 0.74 KDM4E (0.52) KDM4EMAPTTHRBGPR119HPGD

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
EP-4626423-A1 CDK INHIBITORS AND METHODS AND USE THEREOF Relay Therapeutics, Inc. (US) 2025-10-08 EP disclosed
WO-2024119122-A1 CDK INHIBITORS AND METHODS AND USE THEREOF RELAY THERAPEUTICS, INC. (US) 2024-06-06 WO disclosed