SCHEMBL9304319

SCHEMBL9304319

CN(C)c1ccc2nc(Cl)oc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 4/20 0.46
TERT O14746 1/20 0.46
EGFR P00533 2/20 0.41
PIK3CG P48736 1/20 0.40
APAF1 O14727 2/20 0.39
SLC16A3 O15427 1/20 0.39
ELANE P08246 2/20 0.38
SLC2A1 P11166 1/20 0.38
PSMB5 P28074 4/20 0.38
RAB9A P51151 2/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
CASP3 P42574 1/20 0.38
KMT2A Q03164 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
USP2 O75604 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PSMB8 P28062 1/20 0.37

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
SCHEMBL19914324 0.81 AGPAT2 (0.37) PIK3CGSLC16A3ELANERAB9AMEN1
SCHEMBL19914415 0.77 SMN1; SMN2 (0.40) PIK3CGSLC16A3RAB9AMEN1NPC1
SCHEMBL2541637 0.76 KDM4E (0.59) PIK3CGELANERAB9AMEN1NPC1
SCHEMBL895172 0.75 PIK3CG (0.66) PIK3CGPSMB5RAB9ANPC1CASP3
SCHEMBL24999938 0.75 TERT (0.42) APPTERTEGFRAPAF1SLC16A3
SCHEMBL62512 0.75 MAPT (0.56) APPTERTEGFRAPAF1SLC16A3
SCHEMBL19899588 0.73 POLB (0.45) APPEGFRPIK3CGAPAF1PSMB5
SCHEMBL11170826 0.72 PIK3CG (0.43) PIK3CGPSMB5RAB9AMEN1NPC1
SCHEMBL15157800 0.72 NPC1 (0.58) PIK3CGPSMB5RAB9AMEN1NPC1
SCHEMBL20552113 0.72 PIK3CG (0.43) PIK3CGPSMB5MEN1KMT2ARXFP1

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
US-5347008-A Thio(cyclo) alkanepolycarboxylic acids containing heterocyclic substituents CIBA-GEIGY CORPORATION (US) 1994-09-13 US disclosed
US-5152929-A Corrosion inhibitors for water systems CIBA-GEIGY CORPORATION (US) 1992-10-06 US disclosed