SCHEMBL24328229

SCHEMBL24328229

N#Cc1cccc2[nH]cc(CI)c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.45
IMPDH2 P12268 1/20 0.43
IMPDH1 P20839 1/20 0.43
NR3C2 P08235 1/20 0.43
MAP2K1 Q02750 1/20 0.41
GPR84 Q9NQS5 3/20 0.41
FFAR1 O14842 1/20 0.41
HTR2A P28223 5/20 0.38
HTR2C P28335 3/20 0.37
DYRK1A Q13627 1/20 0.37
GAA P10253 2/20 0.36
HTR2B P41595 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
DNMT1 P26358 1/20 0.36
RECQL P46063 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
SCHEMBL8546682 0.81 HTR2A (0.62) SLC6A4IMPDH2IMPDH1NR3C2MAP2K1
SCHEMBL26941658 0.80 NR3C2 (0.46) SLC6A4IMPDH2IMPDH1NR3C2MAP2K1
SCHEMBL2293323 0.80 HTR2A (0.61) SLC6A4IMPDH2IMPDH1NR3C2MAP2K1
SCHEMBL14548391 0.77 NR3C2 (0.44) SLC6A4IMPDH2IMPDH1NR3C2MAP2K1
SCHEMBL24243719 0.74 HTR2A (0.50) SLC6A4NR3C2HTR2AHTR2CHTR2B
SCHEMBL24328916 0.74 SMN1; SMN2 (0.57) SLC6A4IMPDH2IMPDH1NR3C2HTR2A
SCHEMBL26508416 0.74 HTR2A (0.66) SLC6A4NR3C2HTR2AHTR2CHTR2B
SCHEMBL31663297 0.74 SLC6A4 (0.48) SLC6A4IMPDH2IMPDH1NR3C2MAP2K1
SCHEMBL3778298 0.74 IMPDH2 (0.47) SLC6A4IMPDH2IMPDH1NR3C2MAP2K1
SCHEMBL12361360 0.74 SLC6A4 (0.48) SLC6A4IMPDH2IMPDH1NR3C2MAP2K1

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
WO-2022078416-A1 NOVEL GLUTAMINE ANALOGS JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2022-04-21 WO disclosed