SCHEMBL23167601

SCHEMBL23167601

COC(=O)C(=O)Nc1c[nH]c2ccc(Cl)cc12.O=C(O)C(=O)Nc1c[nH]c2ccc(Cl)cc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.53
F7 P08709 1/20 0.49
F3 P13726 1/20 0.49
PYGL P06737 1/20 0.46
NHERF1 O14745 1/20 0.44
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
GABRP O00591 3/20 0.43
GABRD O14764 3/20 0.43
GABRA1 P14867 3/20 0.43
GABRB1 P18505 3/20 0.43
GABRG2 P18507 3/20 0.43
GABRB3 P28472 3/20 0.43
GABRA5 P31644 3/20 0.43
GABRA3 P34903 3/20 0.43
GABRA2 P47869 3/20 0.43
GABRB2 P47870 3/20 0.43
GABRA4 P48169 3/20 0.43
GABRE P78334 3/20 0.43
GABRA6 Q16445 3/20 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
SCHEMBL23207500 0.95 NR4A2 (0.58) NR4A2F7F3PYGLNHERF1
SCHEMBL23167610 0.91 F7 (0.58) NR4A2F7F3NHERF1GABRP
Hydrochloric Acid SCHEMBL23167997 0.82 F7 (0.49) NR4A2F7F3NHERF1GABRP
SCHEMBL28847710 0.80 F7 (0.61) NR4A2F7F3PYGLNHERF1
SCHEMBL23167805 0.80 STING1 (0.39) NR4A2THRATHRBMTNR1AMTNR1B
SCHEMBL7902669 0.78 MTNR1A (0.57) NR4A2F7F3PYGLNHERF1
SCHEMBL24630105 0.76 NR4A2 (0.54) NR4A2F7F3PYGLNHERF1
SCHEMBL30386394 0.76 F7 (0.55) NR4A2F7F3PYGLNHERF1
SCHEMBL12545431 0.75 NR4A2 (0.52) NR4A2F7F3NHERF1MTNR1A
SCHEMBL30218664 0.74 NR4A2 (0.52) NR4A2F7F3PYGLNHERF1

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-2021067805-A1 OXALAMIDE HETEROBYCYCLIC COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2021-04-08 WO disclosed