SCHEMBL28787476

SCHEMBL28787476

O=C(O)Cc1c[nH]c2ccc(Br)c(Cl)c12.[NaH]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 3/20 0.54
GAA P10253 2/20 0.54
MEN1 O00255 2/20 0.54
MAPT P10636 2/20 0.54
KMT2A Q03164 2/20 0.54
POLB P06746 1/20 0.54
THRB P10828 1/20 0.54
DNMT1 P26358 1/20 0.54
RECQL P46063 1/20 0.54
CASP6 P55212 1/20 0.54
MCL1 Q07820 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
HPGD P15428 3/20 0.47
TSHR P16473 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
LMNA P02545 1/20 0.47
GLA P06280 1/20 0.47
CYP2C9 P11712 1/20 0.47

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
SCHEMBL4609508 0.98 ALDH1A1 (0.55) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL9755961 0.86 ALDH1A1 (0.58) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL7917193 0.84 GPR17 (0.56) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL31173808 0.81 GPR17 (0.47) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL27519675 0.81 GPR17 (0.47) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL27498673 0.79 GPR17 (0.45) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL3562093 0.78 ALDH1A1 (0.69) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL5387159 0.78 ALDH1A1 (0.49) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL29580629 0.75 ALDH1A1 (0.69) ALDH1A1KDM4EGAAMEN1MAPT
SCHEMBL154385 0.75 ALDH1A1 (0.69) ALDH1A1KDM4EGAAMEN1MAPT

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-102864208-A Quality control product of AV/BV combined test kit and preparation method thereof BEIJING ZHONGSHENG JINYU DIAGNOSIS TECHNOLOGY CO LTD 2013-01-09 CN disclosed
CN-101792791-B Kit for detecting bacteria flora in vaginal secretion and preparation method thereof BEIJING ZHONGSHENG JINYU DIAGNOSIS TECHNOLOGY CO., LTD. (CN) 2011-12-21 CN disclosed
CN-101792791-A Kit for detecting bacteria flora in vaginal discharge and preparation method thereof BEIJING ZHONGSHENG JINYU DIAGNOSTIC TECHNOLOGY CO LTD 2010-08-04 CN disclosed