SCHEMBL9617399

SCHEMBL9617399

O=C1N=NC(I)c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
POLB P06746 2/20 0.40
ALDH1A1 P00352 2/20 0.36
ALOX15 P16050 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CDC25B P30305 2/20 0.32
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
S100A4 P26447 2/20 0.31
MAPK1 P28482 3/20 0.31
NPC1 O15118 2/20 0.31
KDM4E B2RXH2 2/20 0.31
TDP2 O95551 2/20 0.31
MAPT P10636 2/20 0.31
HTT P42858 2/20 0.31
GALK1 P51570 2/20 0.31
BLM P54132 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
MAOA P21397 2/20 0.31

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
SCHEMBL4060635 0.76 MEN1 (0.40) MEN1KMT2APOLBALDH1A1ALOX15
SCHEMBL6314591 0.76 MEN1 (0.40) MEN1KMT2APOLBALDH1A1ALOX15
SCHEMBL11052520 0.76 POLB (0.40) MEN1KMT2APOLBALDH1A1ALOX15
SCHEMBL1032657 0.76 KMT2A (0.40) MEN1KMT2APOLBALDH1A1ALOX15
SCHEMBL11411069 0.76 POLB (0.40) MEN1KMT2APOLBALDH1A1ALOX15
SCHEMBL5338145 0.74 MEN1 (0.35) MEN1KMT2APOLBALDH1A1ALOX15
SCHEMBL8011185 0.73 ALDH1A1 (0.46) MEN1KMT2APOLBALDH1A1EDNRB
SCHEMBL10670754 0.73 MEN1 (0.38) MEN1KMT2APOLBALDH1A1ALOX15
SCHEMBL11416663 0.72 MEN1 (0.36) MEN1KMT2APOLBALDH1A1ALOX15
SCHEMBL10512037 0.72 POLB (0.36) MEN1KMT2APOLBALDH1A1ALOX15

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0460825-A1 Photothermographic elements MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-12-11 EP claimed
JP-4232940-A None JP disclosed
JP-H04232940-A THERMAL PHOTOGRAPHIC MATERIAL MINNESOTA MINING & MFG CO <3M> 1992-08-21 JP disclosed
EP-0460825-A1 Photothermographic elements MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-12-11 EP disclosed
EP-0460825-A1 Photothermographic elements MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-12-11 EP disclosed
US-5041368-A Photosensitive silver halide emulsion containing an oxidizing agent, a reducing agent, a binder and a phthalazinone derivati ve MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-08-20 US disclosed
US-5041368-A Photosensitive silver halide emulsion containing an oxidizing agent, a reducing agent, a binder and a phthalazinone derivati ve MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-08-20 US disclosed