SCHEMBL26433252

SCHEMBL26433252

Cc1ccc2c(O)c(I)cc(O)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 2/20 0.41
▸ TP53 P04637 2/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ LDHA P00338 3/20 0.40
▸ LDHB P07195 3/20 0.40
▸ LMNA P02545 3/20 0.39
▸ HTT P42858 1/20 0.39
▸ TTR P02766 1/20 0.39
▸ ALOX15 P16050 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ ALB P02768 2/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ ALOX12 P18054 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ AMY1A P0DUB6 1/20 0.36
▸ CHRM1 P11229 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
SCHEMBL26437114 0.79 LMNA (0.63) TRPA1TP53TDP1LDHALDHB
SCHEMBL29566699 0.75 LDHA (0.48) TRPA1TP53TDP1LDHALDHB
SCHEMBL21751239 0.75 LDHA (0.48) TRPA1TP53TDP1LDHALDHB
SCHEMBL19203130 0.73 LDHA (0.47) TRPA1TP53TDP1LDHALDHB
SCHEMBL11428015 0.73 TRPA1 (0.59) TRPA1TP53TDP1LDHALDHB
SCHEMBL30226822 0.73 LMNA (0.47) TRPA1TP53TDP1LDHALDHB
SCHEMBL30226910 0.73 LDHA (0.42) TRPA1TP53TDP1LDHALDHB
SCHEMBL9656536 0.73 HIF1A (0.46) TRPA1TP53TDP1LMNAALOX15
SCHEMBL29566489 0.70 PKM (0.52) TRPA1TP53TDP1LDHALDHB
SCHEMBL21751240 0.70 PKM (0.52) TRPA1TP53TDP1LDHALDHB

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
WO-2023069894-A1 HIGH SELECTIVITY AND HIGH CO2 PLASTICIZATION RESISTANT POLYMERIC MEMBRANES FOR GAS SEPARATIONS UOP LLC (US) 2023-04-27 — — WO disclosed
WO-2023069896-A1 PROTON-EXCHANGE MEMBRANES FOR ELECTROCHEMICAL REACTIONS UOP LLC (US) 2023-04-27 — — WO disclosed
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