SCHEMBL18290079

SCHEMBL18290079

CC(=O)Oc1c(I)cc(I)cc1CO

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.46
▸ NLRP3 Q96P20 1/20 0.46
▸ CYP4F2 P78329 2/20 0.40
▸ CYP4A11 Q02928 2/20 0.40
▸ BACE1 P56817 2/20 0.40
▸ HTT P42858 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ TTR P02766 1/20 0.35
▸ ALOX5 P09917 2/20 0.34
▸ LMNA P02545 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ TOP1 P11387 1/20 0.33

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
SCHEMBL10874720 0.84 POLB (0.48) POLBNLRP3CYP4F2CYP4A11BACE1
SCHEMBL25941557 0.83 POLB (0.42) POLBNLRP3CYP4F2CYP4A11BACE1
SCHEMBL18290075 0.78 POLB (0.48) POLBNLRP3BACE1HTTMAPT
SCHEMBL24106111 0.77 MAPT (0.38) POLBNLRP3CYP4F2CYP4A11BACE1
SCHEMBL25571434 0.77 POLB (0.40) POLBNLRP3BACE1HTTKDM4E
SCHEMBL4317657 0.75 POLB (0.56) POLBNLRP3BACE1KDM4EGAA
SCHEMBL14369565 0.75 CA2 (0.45) POLBNLRP3CYP4F2CYP4A11BACE1
SCHEMBL25571438 0.75 POLB (0.41) POLBNLRP3CYP4F2CYP4A11BACE1
SCHEMBL10875516 0.74 POLB (0.58) POLBNLRP3BACE1HTTMAPT
SCHEMBL27698991 0.74 KDM4E (0.41) POLBNLRP3BACE1HTTMAPT

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-2016193136-A1 HALOGENATED SALICYLANILIDES FOR TREATING CLOSTRIDIUM INFECTIONS ANTIBIOTX APS (DK) 2016-12-08 — — WO disclosed
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