SCHEMBL24615643

SCHEMBL24615643

CC(C)c1ccc(Cl)c2sc(N)nc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.66
LMNA P02545 5/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
PDE10A Q9Y233 1/20 0.41
ALDH1A1 P00352 3/20 0.38
HTT P42858 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SCN4A P35499 1/20 0.35
HPGD P15428 3/20 0.34
TSHR P16473 1/20 0.34
ILK Q13418 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TP53 P04637 1/20 0.33
CXCR2 P25025 2/20 0.33
ALOX15 P16050 1/20 0.32

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
SCHEMBL20315206 0.81 HTT (0.42) SMN1; SMN2LMNAMEN1KMT2AMAPT
SCHEMBL23512523 0.80 SMN1; SMN2 (0.41) SMN1; SMN2LMNAPDE10AALDH1A1HTT
SCHEMBL6664363 0.80 SMN1; SMN2 (1.00) SMN1; SMN2LMNAKDM4EMEN1KMT2A
SCHEMBL27051812 0.78 SMN1; SMN2 (0.49) SMN1; SMN2LMNAPDE10AALDH1A1HTT
SCHEMBL101871 0.77 SMN1; SMN2 (0.72) SMN1; SMN2LMNAKDM4EMEN1KMT2A
SCHEMBL27051825 0.75 SMN1; SMN2 (0.53) SMN1; SMN2LMNAKDM4EMEN1KMT2A
SCHEMBL24785703 0.75 HTT (0.46) SMN1; SMN2LMNAMEN1KMT2AMAPT
SCHEMBL27051957 0.74 SMN1; SMN2 (0.49) SMN1; SMN2LMNAPDE10AALDH1A1HTT
SCHEMBL25167805 0.74 SMN1; SMN2 (0.72) SMN1; SMN2LMNAKDM4EMEN1KMT2A
SCHEMBL21591736 0.74 SMN1; SMN2 (0.72) SMN1; SMN2LMNAKDM4EMEN1KMT2A

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-2022148422-A1 BRIDGED COMPOUNDS AS KRAS G12D INHIBITOR AND DEGRADER AND THE USE THEREOF BEIGENE, LTD. (KY) 2022-07-14 WO disclosed