SCHEMBL5748434

SCHEMBL5748434

CCCCCCc1c[c]nc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.47
TLR8 Q9NR97 7/20 0.44
KDM4E B2RXH2 1/20 0.44
USP2 O75604 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GLA P06280 1/20 0.44
CYP3A4 P08684 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
HSD17B10 Q99714 1/20 0.44
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
ATM Q13315 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TLR7 Q9NYK1 1/20 0.40

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
SCHEMBL5749217 1.00 LIPG (0.47) LIPGTLR8KDM4EUSP2ALDH1A1
SCHEMBL5747472 1.00 LIPG (0.47) LIPGTLR8KDM4EUSP2ALDH1A1
SCHEMBL5747680 0.79 TLR8 (0.49) LIPGTLR8
SCHEMBL5749970 0.79 TLR8 (0.49) LIPGTLR8
SCHEMBL5748731 0.79 TLR8 (0.49) LIPGTLR8
SCHEMBL6114811 0.73 LOXL2 (0.53) LIPGTLR8KDM4EUSP2ALDH1A1
SCHEMBL6115140 0.73 LOXL2 (0.53) LIPGTLR8KDM4EUSP2ALDH1A1
SCHEMBL10585446 0.73 LOXL2 (0.53) LIPGTLR8KDM4EUSP2ALDH1A1
SCHEMBL6114968 0.73 LOXL2 (0.53) LIPGTLR8KDM4EUSP2ALDH1A1
SCHEMBL6114551 0.73 LOXL2 (0.53) LIPGTLR8KDM4EUSP2ALDH1A1

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