SCHEMBL6683733

SCHEMBL6683733

N#P(O)N(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.39
ALDH1A1 P00352 6/20 0.36
L3MBTL1 Q9Y468 4/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.33
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HTT P42858 2/20 0.32
NPC1 O15118 1/20 0.32
POLB P06746 1/20 0.32
FAAH O00519 1/20 0.32
PHGDH O43175 1/20 0.32
MGLL Q99685 1/20 0.32
GLA P06280 1/20 0.32
TSHR P16473 1/20 0.32
CA12 O43570 1/20 0.32

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
SCHEMBL11080870 0.71 KMT2A (0.43) NPSR1ALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL28141806 0.69 ALDH1A1 (0.55) NPSR1ALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL10787980 0.67 L3MBTL1 (0.39) NPSR1ALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL9362471 0.67 ALDH1A1 (0.36) NPSR1ALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL9362365 0.67 ALDH1A1 (0.36) NPSR1ALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL9362931 0.67 ALDH1A1 (0.36) NPSR1ALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL25256206 0.67 TSHR (0.36) NPSR1ALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL2576486 0.65 TDP1 (0.43) NPSR1ALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL28953716 0.64 ALDH1A1 (0.63) NPSR1ALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL6827619 0.64 ALDH1A1 (0.45) NPSR1ALDH1A1RAB9ANPC1MGLL

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
WO-2004065305-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE UNIVERSITY OF DAYTON (US) 2004-08-05 WO disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed