SCHEMBL30320240

SCHEMBL30320240

COC(=O)C1(O)Cc2ccccc2C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HDAC9 Q9UKV0 1/20 0.41
POLB P06746 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
NOTUM Q6P988 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 2/20 0.39
HCN1 O60741 3/20 0.38
HCN4 Q9Y3Q4 1/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 2/20 0.38
TSHR P16473 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CHRM1 P11229 1/20 0.37
NPC1 O15118 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL16836038 0.88 HCN1 (0.41) MEN1KMT2AHDAC9HCN1HCN4
SCHEMBL12203632 0.82 MEN1 (0.44) MEN1KMT2AHDAC9POLBL3MBTL1
SCHEMBL16836097 0.80 KDM4E (0.39) MEN1KMT2APOLBNOTUMMAPT
SCHEMBL1470334 0.80 MEN1 (0.47) MEN1KMT2AHDAC9POLBL3MBTL1
SCHEMBL17027549 0.80 NOTUM (0.46) MEN1KMT2AL3MBTL1NOTUMMAPT
SCHEMBL16836131 0.79 BRD4 (0.52) MEN1KMT2APOLBMAPTHTT
SCHEMBL29896401 0.79 CXCR5 (0.41) MEN1KMT2ANOTUMALDH1A1KDM4E
SCHEMBL28469827 0.79 CXCR5 (0.41) MEN1KMT2ANOTUMALDH1A1KDM4E
SCHEMBL22729870 0.78 MEN1 (0.42) MEN1KMT2AHDAC9POLBL3MBTL1
SCHEMBL1561351 0.78 MEN1 (0.42) MEN1KMT2AHDAC9POLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115974808-B Preparation method of 2-benzyl-7-chloro [1,2-e ] indeno [1,3,4] oxadiazine dimethyl ester 大连奇凯医药科技有限公司 2024-03-12 CN claimed
CN-115974808-A Preparation method of 2-benzyl-7-chlorine [1,2-e ] indeno [1,3,4] oxadiazine methyl diformate 大连奇凯医药科技有限公司 2023-04-18 CN claimed
CN-115974808-B Preparation method of 2-benzyl-7-chloro [1,2-e ] indeno [1,3,4] oxadiazine dimethyl ester 大连奇凯医药科技有限公司 2024-03-12 CN disclosed
CN-115974808-B Preparation method of 2-benzyl-7-chloro [1,2-e ] indeno [1,3,4] oxadiazine dimethyl ester 大连奇凯医药科技有限公司 2024-03-12 CN disclosed
CN-115974808-A Preparation method of 2-benzyl-7-chlorine [1,2-e ] indeno [1,3,4] oxadiazine methyl diformate 大连奇凯医药科技有限公司 2023-04-18 CN disclosed
CN-115974808-A Preparation method of 2-benzyl-7-chlorine [1,2-e ] indeno [1,3,4] oxadiazine methyl diformate 大连奇凯医药科技有限公司 2023-04-18 CN disclosed