SCHEMBL22444720

SCHEMBL22444720

SCc1ccc2[nH]cnc2c1.[Zn]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.41
APEX1 P27695 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PRKCI P41743 1/20 0.39
QPCT Q16769 3/20 0.38
RAD52 P43351 1/20 0.38
CBFB Q13951 1/20 0.37
MMP12 P39900 1/20 0.36
IDO1 P14902 1/20 0.35
CYP3A4 P08684 1/20 0.35
NAMPT P43490 1/20 0.35
XDH P47989 1/20 0.35
POLB P06746 1/20 0.34
IP6K1 Q92551 1/20 0.33
IP6K3 Q96PC2 1/20 0.33
IP6K2 Q9UHH9 1/20 0.33

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
SCHEMBL2022694 0.98 MAPT (0.42) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL22444722 0.85 PRKCI (0.52) MAPTKDM4EALDH1A1TDP1PRKCI
SCHEMBL2022696 0.83 PRKCI (0.53) MAPTKDM4EALDH1A1TDP1PRKCI
SCHEMBL14638352 0.79 MAPT (0.42) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL20472285 0.79 MAPT (0.42) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL23366491 0.79 MAPT (0.42) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL763175 0.79 MAPT (0.42) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL14200123 0.79 MAPT (0.42) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL3819646 0.79 MAPT (0.42) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL1050653 0.79 MAPT (0.47) MAPTKDM4EALDH1A1APEX1RECQL

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-110382652-B Resistance regulator 株式会社大阪曹达 2023-02-28 CN disclosed
WO-2020189533-A1 FLAME-RETARDANT RESIN COMPOSITION, AND CABLE AND WIRE HARNESS USING SAME 株式会社フジクラ 2020-09-24 WO disclosed