SCHEMBL27985462

SCHEMBL27985462

NCC(=O)Oc1ccccc1Cl.[KH]

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2B Q14289 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
PKM P14618 1/20 0.44
CXCL8 P10145 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
BCHE P06276 1/20 0.43
LMNA P02545 1/20 0.43
HDAC6 Q9UBN7 1/20 0.42
HTT P42858 2/20 0.41
HPGD P15428 1/20 0.41
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
TP53 P04637 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPT P10636 2/20 0.41
POLB P06746 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
NFKB1 P19838 1/20 0.40

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
SCHEMBL635048 0.98 PTK2B (0.45) PTK2BMEN1KMT2APKMCXCL8
SCHEMBL30140858 0.98 PTK2B (0.45) PTK2BMEN1KMT2APKMCXCL8
SCHEMBL28122214 0.96 PTK2B (0.44) PTK2BMEN1KMT2APKMCXCL8
Hydrochloric Acid SCHEMBL27850668 0.96 PTK2B (0.44) PTK2BMEN1KMT2APKMCXCL8
SCHEMBL5842469 0.84 MRGPRX4 (0.43) MEN1KMT2AHTTTP53L3MBTL1
SCHEMBL8496813 0.82 PTK2B (0.47) PTK2BMEN1KMT2APKMCXCL8
SCHEMBL28189795 0.81 MEN1 (0.50) PTK2BMEN1KMT2APKMCXCL8
SCHEMBL27645038 0.81 KMT2A (0.46) PTK2BMEN1KMT2APKMCXCL8
SCHEMBL8498810 0.79 KMT2A (0.50) PTK2BMEN1KMT2APKMCXCL8
SCHEMBL578720 0.79 ELANE (0.46) PTK2BMEN1KMT2APKMCXCL8

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-109912439-B Method for continuously and rapidly preparing DL-phenylglycine and analogue thereof by using cyanohydrin method 天宝动物营养科技股份有限公司 2022-09-23 CN disclosed
CN-109912439-A Method for continuously and rapidly preparing DL-phenylglycine and analogue thereof by using cyanohydrin method 禄丰天宝磷化工有限公司 2019-06-21 CN disclosed
CN-104230978-A Preparation midbody for Ezetimibe and preparation method of preparation midbody SHANGSHAI SHYNDEC PHARMACEUTICAL CO LTD 2014-12-24 CN disclosed