SCHEMBL29495175

SCHEMBL29495175

COC(=O)c1cc(Br)cc2ncn(COCC[Si](C)(C)C)c12

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
USP2 O75604 1/20 0.34
LMNA P02545 1/20 0.34
DGAT1 O75907 2/20 0.33
OPRK1 P41145 7/20 0.32
BRD4 O60885 2/20 0.32
CREBBP Q92793 1/20 0.32
ACHE P22303 1/20 0.32
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL25395444 1.00 TSHR (0.34) TSHRUSP2LMNADGAT1OPRK1
SCHEMBL29495203 0.89 DGAT1 (0.34) LMNADGAT1BRD4CREBBPACHE
SCHEMBL22932790 0.89 DGAT1 (0.34) LMNADGAT1BRD4CREBBPACHE
SCHEMBL31056179 0.85 DGAT1 (0.33) DGAT1BRD4CREBBP
SCHEMBL22717531 0.82 KDM4E (0.40) TSHRUSP2LMNADGAT1BRD4
SCHEMBL30258024 0.80 ACHE (0.44) TSHRUSP2LMNAOPRK1ACHE
SCHEMBL25262955 0.80 ACHE (0.44) TSHRUSP2LMNAOPRK1ACHE
SCHEMBL31056181 0.80 MAPK1 (0.35) TSHRLMNADGAT1OPRK1MAPK1
SCHEMBL24501448 0.80 USP2 (0.40) TSHRUSP2LMNADGAT1BRD4
SCHEMBL30640065 0.80 USP2 (0.40) TSHRUSP2LMNADGAT1BRD4

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-119431323-A Heterobicyclic amides as CD38 inhibitors 贝林格尔·英格海姆国际有限公司 2025-02-14 CN disclosed
CN-114423753-B Heterobicyclic amides as CD38 inhibitors 里邦医疗公司 2024-09-17 CN disclosed
CN-114423753-A Heterobicyclic amides as CD38 inhibitors 里邦医疗公司 2022-04-29 CN disclosed