SCHEMBL9188311

SCHEMBL9188311

Cc1cccc(Nc2ccc(-c3ccccc3)c(Nc3cccc(C)c3)c2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.62
▸ L3MBTL1 Q9Y468 3/20 0.48
▸ FLT1 P17948 1/20 0.47
▸ FLT4 P35916 1/20 0.47
▸ KDR P35968 1/20 0.47
▸ MAPT P10636 7/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ ABCB1 P08183 1/20 0.46
▸ ABCG2 Q9UNQ0 1/20 0.46
▸ TP53 P04637 2/20 0.45
▸ HPGD P15428 2/20 0.44
▸ ADORA2A P29274 1/20 0.43
▸ AKR1C3 P42330 2/20 0.43
▸ AKR1C2 P52895 2/20 0.43
▸ ALDH1A1 P00352 4/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ AR P10275 1/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42

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
SCHEMBL920145 0.87 NPSR1 (0.67) NPSR1L3MBTL1FLT1FLT4KDR
SCHEMBL17246942 0.87 NPSR1 (0.61) NPSR1L3MBTL1FLT1FLT4KDR
SCHEMBL30161167 0.84 NPSR1 (0.68) NPSR1L3MBTL1FLT1FLT4KDR
SCHEMBL2504962 0.84 NPSR1 (0.62) NPSR1L3MBTL1FLT1FLT4KDR
SCHEMBL21234632 0.83 ALDH1A1 (0.48) NPSR1L3MBTL1MAPTSMN1; SMN2HPGD
SCHEMBL530475 0.83 NPSR1 (0.57) NPSR1L3MBTL1FLT1FLT4KDR
SCHEMBL29352577 0.83 NPSR1 (0.57) NPSR1L3MBTL1FLT1FLT4KDR
SCHEMBL24174910 0.82 NPSR1 (0.59) NPSR1L3MBTL1FLT1FLT4KDR
SCHEMBL26134259 0.82 NPSR1 (0.55) NPSR1L3MBTL1FLT1FLT4KDR
Diphenylamine SCHEMBL4934789 0.81 NPSR1 (0.81) NPSR1L3MBTL1FLT1FLT4KDR

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
EP-0455247-B1 m-Phenylenediamine compound and electrophotosensitive material using said compound MITA INDUSTRIAL CO LTD (JP) 1995-09-13 — — EP disclosed
EP-0455247-A2 m-Phenylenediamine compound and electrophotosensitive material using said compound MITA INDUSTRIAL CO. LTD. (JP) 1991-11-06 — — EP disclosed
Send feedback