SCHEMBL29050845

SCHEMBL29050845

CC(C)(Br)C(=O)Oc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ELANE P08246 16/20 0.59
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46
LMNA P02545 1/20 0.45
PRTN3 P24158 4/20 0.42
PRSS1 P07477 1/20 0.40
ACR P10323 1/20 0.40
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
NT5E P21589 1/20 0.39

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
SCHEMBL6337153 0.87 ELANE (0.77) ELANEPRTN3
SCHEMBL18119838 0.87 ELANE (0.77) ELANEPOLBMAPTPKMPRTN3
SCHEMBL7183398 0.86 ELANE (0.74) ELANEPRTN3
SCHEMBL2740677 0.81 ELANE (0.54) ELANEPOLBMAPTPKMLMNA
SCHEMBL14155779 0.80 ELANE (0.51) ELANEPOLBMAPTPKMLMNA
SCHEMBL25844994 0.79 ELANE (0.47) ELANEPOLBMAPTPKMPRTN3
SCHEMBL14012162 0.79 ELANE (0.55) ELANE
SCHEMBL19266119 0.78 ELANE (0.50) ELANEPOLBMAPTPKMLMNA
SCHEMBL437118 0.77 ELANE (0.53) ELANEMAPTLMNAALDH1A1
SCHEMBL3161812 0.77 MAPT (0.74) ELANEPOLBMAPTPKMLMNA

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
CN-116593556-A Temperature-responsive yeast cell imprinting modified electrode and preparation method and application thereof 辽宁师范大学 2023-08-15 CN disclosed