SCHEMBL5748614

SCHEMBL5748614

CCc1ccc2ccc3cc[c]c4ccc1c2c43

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL5746832 1.00 MEN1 (0.34) MEN1KMT2AALDH1A1CYP3A4HPGD
SCHEMBL5748296 0.83 CYP1A2 (0.37) MEN1KMT2AALDH1A1CYP3A4HPGD
SCHEMBL5749859 0.82 MEN1 (0.38) MEN1KMT2AALDH1A1CYP3A4HPGD
SCHEMBL5747464 0.82 MEN1 (0.38) MEN1KMT2AALDH1A1CYP3A4HPGD
SCHEMBL5748032 0.82 MEN1 (0.38) MEN1KMT2AALDH1A1CYP3A4HPGD
SCHEMBL5747427 0.82 MEN1 (0.38) MEN1KMT2AALDH1A1CYP3A4HPGD
SCHEMBL5746385 0.82 MEN1 (0.38) MEN1KMT2AALDH1A1CYP3A4HPGD
SCHEMBL5750182 0.82 MEN1 (0.38) MEN1KMT2AALDH1A1CYP3A4HPGD
SCHEMBL28812963 0.80 MEN1 (0.36) MEN1KMT2A
SCHEMBL5749129 0.79 ALDH1A1 (0.37) MEN1KMT2AALDH1A1CYP3A4HPGD

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-20060293503-A1 Polyaminopyridines and method for producing same SUMITOMO SEIKA CHEMICALS CO., LTD (JP) 2006-12-28 US disclosed
EP-1669390-A1 POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2006-06-14 EP disclosed