SCHEMBL25818076

SCHEMBL25818076

CC(=O)CN1CCN(c2ccc(N3CCC(=O)NC3=O)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 6/20 0.52
CRBN Q96SW2 6/20 0.52
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.40
USP2 O75604 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
MAPT P10636 2/20 0.40
GFER P55789 2/20 0.39
S1PR1 P21453 1/20 0.39
CASP6 P55212 1/20 0.38
CYP2C9 P11712 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL30678689 0.87 DDB1 (0.56) DDB1CRBNALDH1A1KDM4EHPGD
SCHEMBL31586109 0.79 DDB1 (0.50) DDB1CRBN
SCHEMBL29007105 0.78 CRBN (0.59) DDB1CRBNALDH1A1KDM4EHPGD
SCHEMBL2715987 0.77 GFER (0.63) ALDH1A1KDM4ESMN1; SMN2USP2ALOX15
SCHEMBL31587053 0.77 HTR1A (0.48) DDB1CRBNALDH1A1MAPT
SCHEMBL31586422 0.77 HTR1A (0.48) DDB1CRBNALDH1A1MAPT
SCHEMBL30805378 0.76 L3MBTL1 (0.58) DDB1CRBNALDH1A1KDM4EHPGD
SCHEMBL30678685 0.76 DDB1 (0.58) DDB1CRBNALDH1A1KDM4EHPGD
SCHEMBL22144673 0.75 CRBN (0.67) DDB1CRBNALDH1A1KDM4EHPGD
SCHEMBL30678700 0.75 DDB1 (0.60) DDB1CRBNALDH1A1KDM4EHPGD

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-2023116934-A1 KRASG12D PROTEIN HYDROLYSIS REGULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 苏州泽璟生物制药股份有限公司 2023-06-29 WO disclosed