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Sugi Predict / Compounds / SCHEMBL9876665

SCHEMBL9876665

SCHEMBL9876665

CCCCCCCCCCCCCCCCNS(=O)(=O)c1c(C)ccc(-n2oc(C(C)(C)C)c(COc3ccc(N)cc3)c2=O)c1[N+](=O)[O-]

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NCOA1 Q15788 1/20 0.31
▸ NCOA3 Q9Y6Q9 1/20 0.31
▸ TBXA2R P21731 3/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 2/20 0.30
▸ HTT P42858 2/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ MAPK1 P28482 1/20 0.30

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
SCHEMBL9876455 0.86 HTT (0.32) TBXA2RALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL9876854 0.86 HTT (0.32) TBXA2RALDH1A1LMNAHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL9864700 0.77 ALDH1A1 (0.48) ALDH1A1LMNAHTTSMN1; SMN2MAPK1
SCHEMBL9876484 0.76 MAPT (0.34) TBXA2RALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL9771372 0.76 MAPT (0.34) TBXA2RALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL9877541 0.70 ALDH1A1 (0.38) ALDH1A1LMNASMN1; SMN2MAPK1
SCHEMBL27661888 0.59 CA12 (0.75) ALDH1A1LMNAHTTSMN1; SMN2MAPK1
SCHEMBL27843904 0.59 CA12 (0.75) ALDH1A1LMNAHTTSMN1; SMN2MAPK1
SCHEMBL8761233 0.59 CA12 (0.75) ALDH1A1LMNAHTTSMN1; SMN2MAPK1
SCHEMBL27681903 0.59 CA12 (0.75) ALDH1A1LMNAHTTSMN1; SMN2MAPK1

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
US-5049477-A Image forming, etching, plating FUJI PHOTO FILM CO., LTD. (JP) 1991-09-17 — — US disclosed