SCHEMBL26170503

SCHEMBL26170503

CC(C)C1CCN(C(=O)[C@@H]2CCN(C(C)C)C2)CC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.49
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 4/20 0.38
CYP2D6 P10635 2/20 0.36
KCNH2 Q12809 1/20 0.36
HPGD P15428 2/20 0.35
TSHR P16473 1/20 0.35
HSD11B1 P28845 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
ATR Q13535 1/20 0.34
MAPT P10636 1/20 0.33
GAA P10253 1/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL26494224 0.90 HRH3 (0.55) HRH3SMN1; SMN2ALDH1A1CYP2D6KCNH2
SCHEMBL14453911 0.85 HRH3 (0.60) HRH3SMN1; SMN2ALDH1A1CYP2D6KCNH2
SCHEMBL18704924 0.85 HPGD (0.52) HRH3SMN1; SMN2ALDH1A1HPGDTSHR
SCHEMBL25480249 0.84 HRH3 (0.56) HRH3SMN1; SMN2ALDH1A1CYP2D6KCNH2
SCHEMBL25480250 0.84 HRH3 (0.56) HRH3SMN1; SMN2ALDH1A1CYP2D6KCNH2
SCHEMBL26170554 0.83 HRH3 (0.46) HRH3SMN1; SMN2ALDH1A1CYP2D6KCNH2
SCHEMBL14472575 0.82 HTT (0.51) HRH3ALDH1A1TSHRKMT2A
SCHEMBL12384645 0.82 NAMPT (0.43) HRH3SMN1; SMN2ALDH1A1HPGDTSHR
SCHEMBL26170628 0.81 HSD11B1 (0.58) HRH3SMN1; SMN2ALDH1A1HSD11B1MEN1
SCHEMBL26171347 0.81 HRH3 (0.47) HRH3SMN1; SMN2ALDH1A1CYP2D6KCNH2

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-2023098656-A1 COMPOUNDS FOR THE DEGRADATION OF EGFR KINASE BEIGENE, LTD. (GB) 2023-06-08 WO disclosed