SCHEMBL20577100

SCHEMBL20577100

Brc1cc[c]c(OCc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.53
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
CCR5 P51681 2/20 0.40
SLC6A4 P31645 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA5 P31644 1/20 0.40
GABRA3 P34903 1/20 0.40
USP28 Q96RU2 1/20 0.40
USP25 Q9UHP3 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.40
ALOX5 P09917 1/20 0.40
HTT P42858 1/20 0.39
PTGES O14684 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL15474793 0.81 LMNA (0.47) MAOBHPGDTHRATHRBALOX5
SCHEMBL2093026 0.81 ALOX5 (0.53) MAOBGAAMAPTRAB9AALOX5
SCHEMBL4315473 0.79 SLC6A4 (0.40) MAOBTHRATHRBSLC6A4ALOX5
SCHEMBL10743886 0.79 MAOB (0.40) MAOBALOX5LMNACYP1A2PTGS1
SCHEMBL7295428 0.79 L3MBTL1 (0.44) MAOBGAAMAPTHPGDALOX5
SCHEMBL28006547 0.79 CALM1 (0.41) MAOBGAAMAPTHPGDRAB9A
SCHEMBL7468357 0.79 AGXT (0.43) MAOBGABRG2GABRB3GABRA5GABRA3
SCHEMBL28085689 0.78 MAOB (0.49) MAOBGAAMAPTRAB9AALOX5
SCHEMBL2202368 0.77 MAOB (0.58) MAOB
SCHEMBL3320555 0.77 MAOB (0.56) MAOBTHRATHRB

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-118302417-A NLRP3 inhibitors PTC医疗公司 2024-07-05 CN disclosed
CN-110950860-B Fused tricyclic compound and application thereof in medicines 广东东阳光药业有限公司 2023-03-31 CN disclosed
CN-110066278-B Fused tricyclic compound and application thereof in medicines 广东东阳光药业有限公司 2021-06-08 CN disclosed
EP-3694856-A1 FUSED TRICYCLIC COMPOUNDS AND USES THEREOF IN MEDICINE Sunshine Lake Pharma Co., Ltd. (CN) 2020-08-19 EP disclosed
CN-110950860-A Fused tricyclic compound and application thereof in medicines 广东东阳光药业有限公司 2020-04-03 CN disclosed
WO-2019100735-A1 FUSED TRICYCLIC COMPOUNDS AND USES THEREOF IN MEDICINE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2019-05-31 WO disclosed
CN-109704982-A A kind of preparation method of eltrombopag olamine intermediate 2- hydroxyl -3- (carboxyl phenyl) aniline 上海天慈国际药业有限公司 2019-05-03 CN disclosed
WO-2018219356-A1 FUSED TRICYCLIC COMPOUNDS AND USES THEREOF IN MEDICINE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2018-12-06 WO disclosed