SCHEMBL22275502

SCHEMBL22275502

CC(C)(C)[Si](C)(C)OCc1cnc(CBr)s1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
ATM Q13315 1/20 0.38
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 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
SCHEMBL15283881 0.83 L3MBTL1 (0.38) L3MBTL1LMNAPOLBRAB9AATM
SCHEMBL25269614 0.83 LOXL2 (0.40) L3MBTL1LMNAPOLBRAB9AATM
SCHEMBL15284143 0.83 POLB (0.38) L3MBTL1LMNAPOLBRAB9AATM
SCHEMBL861151 0.83 L3MBTL1 (0.40) L3MBTL1LMNAPOLBRAB9AATM
SCHEMBL18667064 0.79 L3MBTL1 (0.43) L3MBTL1LMNAPOLBRAB9AATM
SCHEMBL2060454 0.78 POLB (0.44) L3MBTL1LMNAPOLBRAB9AATM
SCHEMBL21250399 0.78 L3MBTL1 (0.36) L3MBTL1LMNAPOLBRAB9AATM
SCHEMBL861090 0.78 L3MBTL1 (0.38) L3MBTL1LMNAPOLBRAB9AATM
SCHEMBL25184349 0.77 L3MBTL1 (0.34) L3MBTL1LMNAPOLBRAB9AATM
Bromide SCHEMBL15009498 0.77 L3MBTL1 (0.38) L3MBTL1LMNAPOLBRAB9AATM

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112204036-B Macrocyclic fused pyrazoles as MCL-1 inhibitors 苏州亚盛药业有限公司 2022-12-27 CN disclosed
CN-112204036-A Macrocyclic fused pyrazoles as MCL-1 inhibitors 苏州亚盛药业有限公司 2021-01-08 CN disclosed
WO-2020151738-A1 MACROCYCLIC FUSED PYRRAZOLES AS MCL-1 INHIBITORS ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) 2020-07-30 WO disclosed