SCHEMBL4784300

SCHEMBL4784300

CCCCCc1nnccc1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
DHFR P00374 1/20 0.39
KDM4E B2RXH2 2/20 0.38
RAB9A P51151 2/20 0.38
ALDH1A1 P00352 2/20 0.37
HTR2A P28223 2/20 0.36
KCNH2 Q12809 1/20 0.36
TLR8 Q9NR97 2/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35

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
SCHEMBL6132072 0.79 TDP1 (0.42) TDP1L3MBTL1DHFRKDM4EALDH1A1
SCHEMBL22698156 0.78
SCHEMBL28164503 0.78 TDP1 (0.41) TDP1L3MBTL1DHFRKDM4EALDH1A1
SCHEMBL28547139 0.78 TDP1 (0.41) TDP1L3MBTL1DHFRKDM4EALDH1A1
SCHEMBL28164575 0.78 TDP1 (0.41) TDP1L3MBTL1DHFRKDM4EALDH1A1
SCHEMBL28992711 0.78 TDP1 (0.41) TDP1L3MBTL1DHFRKDM4EALDH1A1
SCHEMBL28848032 0.78 TDP1 (0.41) TDP1L3MBTL1DHFRKDM4EALDH1A1
SCHEMBL5369216 0.74 TDP1 (0.49) TDP1L3MBTL1DHFRKDM4ERAB9A
SCHEMBL4784302 0.74 TLR8 (0.45) TDP1L3MBTL1KDM4ERAB9AALDH1A1
SCHEMBL28733234 0.74 TDP1 (0.38) TDP1L3MBTL1DHFRKDM4EALDH1A1

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-1042293-B9 SUBSTITUTED PYRIDINE AND PYRIDAZINE COMPOUNDS AND THEIR PHARMACEUTICAL USE AMGEN INC (US) 2008-09-03 EP disclosed
EP-1042293-B1 SUBSTITUTED PYRIDINE AND PYRIDAZINE COMPOUNDS AND THEIR PHARMACEUTICAL USE AMGEN INC (US) 2008-03-19 EP disclosed