SCHEMBL2420665

SCHEMBL2420665

N#CN(C(N)=NCl)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
ALDH1A1 P00352 2/20 0.35
SIGMAR1 Q99720 2/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
C1S P09871 1/20 0.32
PRSS3 P35030 1/20 0.32
RECQL P46063 1/20 0.32
F2 P00734 1/20 0.30
F10 P00742 1/20 0.30
F12 P00748 1/20 0.30
F7 P08709 1/20 0.30
F3 P13726 1/20 0.30

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
SCHEMBL4259665 0.79 KMT2A (0.40) POLBALDH1A1KMT2AMEN1PRSS1
SCHEMBL8082790 0.76 POLB (0.33) POLBALDH1A1
SCHEMBL6137753 0.76 CA2 (0.34) POLBALDH1A1KMT2AMEN1PRSS1
SCHEMBL27328134 0.75 NPSR1 (0.41) POLBALDH1A1KMT2AMEN1CYP3A4
SCHEMBL7426969 0.75 ALDH1A1 (0.54) POLBALDH1A1KMT2AMEN1RECQL
SCHEMBL2420664 0.70 ALDH1A1 (0.31) ALDH1A1
SCHEMBL4582110 0.68 SIGMAR1 (0.36) ALDH1A1SIGMAR1KMT2AMEN1MAPT
SCHEMBL8854244 0.67 KMT2A (0.31) KMT2AMEN1PRSS1PRSS2C1S
SCHEMBL437417 0.67 NPSR1 (0.41) ALDH1A1KMT2AMEN1CYP3A4CYP2C9
SCHEMBL27328209 0.67 IDO1 (0.36) ALDH1A1SIGMAR1KMT2AMEN1CYP1A2

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-111979114-A Black cattle epidemic prevention inspection kit and preparation method thereof 潍坊友容实业有限公司 2020-11-24 CN claimed
EP-2150528-A2 PROCESS FOR PREPARATION OF PROGUANIL HYDROCHLORIDE USV Limited (IN) 2010-02-10 EP claimed
WO-2009113092-A2 PROCESS FOR PREPARATION OF PROGUANIL HYDROCHLORIDE USV LIMITED (IN) 2009-09-17 WO claimed
CN-111979114-A Black cattle epidemic prevention inspection kit and preparation method thereof 潍坊友容实业有限公司 2020-11-24 CN disclosed
EP-2542889-A1 LIGAND GUANIDINYL FUNCTIONALIZED POLYMERS 3M Innovative Properties Company (US) 2013-01-09 EP disclosed
WO-2011109151-A1 LIGAND GUANIDINYL FUNCTIONALIZED POLYMERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-09-09 WO disclosed
EP-2150528-A2 PROCESS FOR PREPARATION OF PROGUANIL HYDROCHLORIDE USV Limited (IN) 2010-02-10 EP disclosed
WO-2009113092-A2 PROCESS FOR PREPARATION OF PROGUANIL HYDROCHLORIDE USV LIMITED (IN) 2009-09-17 WO disclosed