SCHEMBL29201751

SCHEMBL29201751

CC(C)[C@@H](CO)CN1CCN(Cc2ccccc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.56
SIGMAR1 Q99720 4/20 0.56
APOBEC3A P31941 1/20 0.54
RECQL P46063 1/20 0.54
APOBEC3G Q9HC16 1/20 0.54
MC4R P32245 1/20 0.53
LMNA P02545 2/20 0.51
POLB P06746 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
IGF1R P08069 1/20 0.50
HTT P42858 1/20 0.49
GAA P10253 1/20 0.49
ATM Q13315 1/20 0.48
ALDH1A1 P00352 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL29201752 1.00 KDM4E (0.56) KDM4ESIGMAR1APOBEC3ARECQLAPOBEC3G
SCHEMBL30816869 0.84 SIGMAR1 (0.60) KDM4ESIGMAR1APOBEC3ARECQLAPOBEC3G
SCHEMBL30816895 0.84 SIGMAR1 (0.60) KDM4ESIGMAR1APOBEC3ARECQLAPOBEC3G
SCHEMBL30864070 0.84 SIGMAR1 (0.60) KDM4ESIGMAR1APOBEC3ARECQLAPOBEC3G
SCHEMBL21164624 0.81 KDM4E (0.64) KDM4ESIGMAR1APOBEC3ARECQLAPOBEC3G
SCHEMBL3312142 0.81 KMT2A (0.69) KDM4ESIGMAR1APOBEC3ARECQLAPOBEC3G
SCHEMBL24672242 0.80 KDM4E (0.68) KDM4ESIGMAR1MC4RLMNAPOLB
SCHEMBL1394539 0.80 KDM4E (0.68) KDM4ESIGMAR1MC4RLMNAPOLB
SCHEMBL21797152 0.80 KDM4E (0.68) KDM4ESIGMAR1MC4RLMNAPOLB
SCHEMBL1394535 0.80 KDM4E (0.68) KDM4ESIGMAR1MC4RLMNAPOLB

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-117917416-A KRAS G12D degradation agent and preparation method and application thereof 上海领泰生物医药科技有限公司 2024-04-23 CN disclosed