SCHEMBL29913871

SCHEMBL29913871

CCOC(=O)c1cc2ccccc2s1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.57
KDM4E B2RXH2 3/20 0.55
RAB9A P51151 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MAPT P10636 2/20 0.55
NPC1 O15118 1/20 0.55
CASP3 P42574 1/20 0.55
ATM Q13315 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
SENP6 Q9GZR1 1/20 0.55
HDAC3 O15379 1/20 0.54
HDAC4 P56524 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC10 Q969S8 1/20 0.54
HDAC11 Q96DB2 1/20 0.54
HDAC8 Q9BY41 1/20 0.54

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
SCHEMBL4405770 1.00 BCL2L1 (0.57) BCL2L1KDM4ERAB9ATDP1L3MBTL1
SCHEMBL7636919 0.84 BCL2L1 (0.54) BCL2L1KDM4ERAB9AL3MBTL1MAPT
SCHEMBL25233727 0.84 BCL2L1 (0.54) BCL2L1RAB9AL3MBTL1HDAC3HDAC4
SCHEMBL11088478 0.84 BCL2L1 (0.57) BCL2L1RAB9AL3MBTL1CASP3SENP7
SCHEMBL2238245 0.83 PTPN2 (0.60) KDM4ERAB9ATDP1L3MBTL1MAPT
SCHEMBL5935775 0.83 RAB9A (0.56) BCL2L1KDM4ERAB9ATDP1L3MBTL1
SCHEMBL1205380 0.83 PTPN2 (0.51) KDM4ERAB9ATDP1L3MBTL1MAPT
SCHEMBL8250276 0.83 HDAC1 (0.60) KDM4ERAB9ATDP1L3MBTL1MAPT
SCHEMBL25306019 0.82 BCL2L1 (0.59) BCL2L1RAB9AL3MBTL1CASP3SENP7
SCHEMBL3608307 0.82 HDAC3 (0.60) BCL2L1RAB9ANPC1CASP3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122059901-A 1,3, 4-Oxadiazole compound and preparation method and application thereof 成都大学 2026-05-19 CN claimed
CN-122059901-A 1,3, 4-Oxadiazole compound and preparation method and application thereof 成都大学 2026-05-19 CN disclosed
CN-115215823-B FXR modulator, preparation method, pharmaceutical composition and application thereof 北京百思致道管理顾问中心(有限合伙) 2024-07-26 CN disclosed
WO-2023202583-A1 FXR REGULATOR AND USE THEREOF 北京大学 2023-10-26 WO disclosed
CN-116903559-A FXR modulators and uses thereof 北京大学 2023-10-20 CN disclosed
CN-115215823-A FXR (FXR) regulator and preparation method, pharmaceutical composition and application thereof 青岛睿吉医疗技术有限公司 2022-10-21 CN disclosed
CN-115023426-A Pesticidally active heterocyclic derivatives with sulfur-containing substituents 先正达农作物保护股份公司 2022-09-06 CN disclosed
CN-110114343-B Pyrazolopyrimidine compounds and methods of use thereof 豪夫迈·罗氏有限公司 2022-09-06 CN disclosed