SCHEMBL28853261

SCHEMBL28853261

O=C(O)C(Br)c1c[nH]c2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
MAPT P10636 3/20 0.56
PKM P14618 1/20 0.56
GPR84 Q9NQS5 4/20 0.54
FFAR1 O14842 2/20 0.54
KDM4E B2RXH2 2/20 0.53
APAF1 O14727 1/20 0.53
POLB P06746 1/20 0.53
RECQL P46063 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
MGAM O43451 6/20 0.52
GAA P10253 6/20 0.52
SI P14410 6/20 0.52
MGAM2 Q2M2H8 6/20 0.52
SMN1; SMN2 Q16637 1/20 0.50
NOD2 Q9HC29 1/20 0.49
LMNA P02545 1/20 0.49
MPO P05164 1/20 0.49
TSHR P16473 1/20 0.49

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
SCHEMBL4020190 0.85 GPR84 (0.53) MEN1KMT2AMAPTPKMGPR84
SCHEMBL6283244 0.84 GPR84 (0.59) MEN1KMT2AMAPTPKMGPR84
SCHEMBL3370820 0.82 MEN1 (0.59) MEN1KMT2AMAPTPKMGPR84
SCHEMBL1893849 0.82 MEN1 (0.59) MEN1KMT2AMAPTPKMGPR84
SCHEMBL7047429 0.82 MEN1 (0.59) MEN1KMT2AMAPTPKMGPR84
SCHEMBL5289034 0.81 MEN1 (0.51) MEN1KMT2AMAPTPKMGPR84
SCHEMBL719008 0.81 MAPT (0.57) MEN1KMT2AMAPTPKMGPR84
SCHEMBL30518932 0.79 MEN1 (0.56) MEN1KMT2AMAPTPKMGPR84
SCHEMBL30518090 0.79 MEN1 (0.56) MEN1KMT2AMAPTPKMGPR84
SCHEMBL1349263 0.79 MEN1 (0.56) MEN1KMT2AMAPTPKMGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109071541-A Phenyl [ a ] indole [2,3-g ] quinolizine compound, preparation method thereof, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2018-12-21 CN disclosed
CN-107286158-A Phenyl [a] indoles [2,3-g] and quinolizine class compound, its preparation method, pharmaceutical composition and its application 中国科学院上海药物研究所 2017-10-24 CN disclosed