SCHEMBL11815812

SCHEMBL11815812

Nc1c(Br)ccc2c(S(=O)(=O)O)cccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 1/20 0.61
▸ AURKA O14965 1/20 0.45
▸ AURKB Q96GD4 1/20 0.45
▸ CDK2 P24941 1/20 0.44
▸ CYP1A2 P05177 2/20 0.44
▸ ATIC P31939 2/20 0.44
▸ SUMO2 P61956 4/20 0.43
▸ SUMO1 P63165 4/20 0.43
▸ SENP7 Q9BQF6 4/20 0.43
▸ SENP2 Q9HC62 4/20 0.43
▸ SENP1 Q9P0U3 3/20 0.43
▸ SENP3 Q9H4L4 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ APP P05067 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ SNCA P37840 1/20 0.41

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
SCHEMBL26638150 0.98 TTR (0.59) TTRAURKAAURKBCDK2CYP1A2
SCHEMBL9808016 0.84 TTR (0.62) TTRAURKAAURKBCDK2CYP1A2
SCHEMBL6937442 0.84 TTR (0.67) TTRAURKAAURKBCDK2CYP1A2
SCHEMBL6051313 0.82 TTR (0.70) TTRAURKAAURKBCDK2CYP1A2
SCHEMBL26638161 0.81 SLC7A11 (0.47) TTRCDK2ALDH1A1APPTHRB
SCHEMBL30736514 0.81 SLC7A11 (0.47) TTRCDK2ALDH1A1APPTHRB
SCHEMBL7775179 0.81 SENP2 (0.55) TTRAURKAAURKBSUMO2SUMO1
SCHEMBL22396639 0.80 TTR (0.60) TTRAURKAAURKBCDK2CYP1A2
SCHEMBL26743894 0.79 TTR (0.61) TTRAURKAAURKBCDK2CYP1A2
SCHEMBL30233642 0.79 TTR (0.75) TTRAURKAAURKBCDK2CYP1A2

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
US-20230358677-A1 Reversible Excited-State Photoacids and Photobases as Dynamic Fluorescence Sensors of Protonic Species CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2023-11-09 — — US disclosed
US-3978040-A Process for the preparation of cyanoazo compounds by reacting halogenoazo compounds with CuCN in an aqueous media in the presence of a nitrogen base BAYER AKTIENGESELLSCHAFT (DT) 1976-08-31 — — US disclosed
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