SCHEMBL28280472

SCHEMBL28280472

O=C(O)c1c(I)ccnc1I

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.38
ASPH Q12797 2/20 0.38
KDM8 Q8N371 2/20 0.38
ALDH1A1 P00352 4/20 0.36
KDM3A Q9Y4C1 3/20 0.36
KDM4A O75164 3/20 0.36
MAPT P10636 2/20 0.36
KDM5A P29375 2/20 0.36
KDM6B O15054 2/20 0.36
KDM5C P41229 2/20 0.36
KDM4C Q9H3R0 2/20 0.36
KDM2A Q9Y2K7 2/20 0.36
EGLN1 Q9GZT9 2/20 0.36
HIF1AN Q9NWT6 2/20 0.36
TET3 O43151 1/20 0.36
BBOX1 O75936 1/20 0.36
KDM4D Q6B0I6 1/20 0.36
TET2 Q6N021 1/20 0.36
ALKBH5 Q6P6C2 1/20 0.36
KDM7A Q6ZMT4 1/20 0.36

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
SCHEMBL31281607 0.83 NAPRT (0.46) KDM4EASPHKDM8ALDH1A1KDM3A
SCHEMBL198077 0.83 NAPRT (0.46) KDM4EASPHKDM8ALDH1A1KDM3A
SCHEMBL197777 0.81 KDM4E (0.37) KDM4EASPHKDM8ALDH1A1KDM3A
SCHEMBL16414207 0.81 CSNK1A1 (0.37) KDM4EALDH1A1SMN1; SMN2CYP3A4
SCHEMBL28000021 0.79 KDM4E (0.38) KDM4EASPHKDM8ALDH1A1KDM3A
SCHEMBL11895139 0.79 NAPRT (0.46) KDM4EASPHKDM8ALDH1A1KDM3A
SCHEMBL1989103 0.79 SMN1; SMN2 (0.46) KDM4EASPHKDM8ALDH1A1KDM3A
SCHEMBL11895141 0.79 HTT (0.42) KDM4EASPHKDM8ALDH1A1KDM3A
SCHEMBL28243763 0.79 KDM4E (0.38) KDM4EASPHKDM8ALDH1A1KDM3A
SCHEMBL8895032 0.76 ALDH1A1 (0.36) KDM4EASPHKDM8ALDH1A1KDM3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109485601-A The synthetic method of 2,6- dihalopyridine -3- carboxylic acid 沧州普瑞东方科技有限公司 2019-03-19 CN disclosed