SCHEMBL5751189

SCHEMBL5751189

N#Cc1c2ccccc2c(N)c2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.52
KDM4E B2RXH2 5/20 0.52
GAA P10253 2/20 0.50
MAPT P10636 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
CACNA1B Q00975 1/20 0.50
APBA1 Q02410 1/20 0.50
HSD17B10 Q99714 3/20 0.43
HPGD P15428 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
LMNA P02545 3/20 0.43
GLA P06280 2/20 0.43
CASP1 P29466 2/20 0.43
CASP7 P55210 2/20 0.43
RAB9A P51151 2/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL14567393 0.87 ALDH1A1 (0.52) ALDH1A1KDM4EGAAMAPTKMT2A
SCHEMBL10694051 0.87 ALDH1A1 (0.52) ALDH1A1KDM4EGAAMAPTKMT2A
SCHEMBL150623 0.87 ALDH1A1 (0.64) ALDH1A1KDM4EGAAMAPTKMT2A
SCHEMBL29429129 0.87 ALDH1A1 (0.64) ALDH1A1KDM4EGAAMAPTKMT2A
SCHEMBL28596694 0.86 ALDH1A1 (0.46) ALDH1A1KDM4EGAAMAPTKMT2A
SCHEMBL21480744 0.86 ALDH1A1 (0.46) ALDH1A1KDM4EGAAMAPTKMT2A
SCHEMBL21480742 0.83 ALDH1A1 (0.48) ALDH1A1KDM4EGAAMAPTKMT2A
SCHEMBL17249776 0.81 GRM6 (0.42) ALDH1A1KDM4EGAAMAPTKMT2A
SCHEMBL148856 0.78 ALDH1A1 (0.59) ALDH1A1KDM4EGAAMAPTKMT2A
SCHEMBL2546104 0.78 ALDH1A1 (0.59) ALDH1A1KDM4EGAAMAPTKMT2A

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