SCHEMBL11123789

SCHEMBL11123789

Cc1nc(C)nc(NC(=O)NS(=O)(=O)c2ccccc2CO)n1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.43
FBP1 P09467 1/20 0.40
CA12 O43570 2/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
LMNA P02545 1/20 0.37
PTGES O14684 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL11122289 0.90 ALDH1A1 (0.47) KDM4ENPC1ALDH1A1MAPTFBP1
SCHEMBL11123787 0.89 LMNA (0.48) KDM4ENPC1ALDH1A1MAPTLMNA
SCHEMBL11047166 0.86 KDM4E (0.43) KDM4ENPC1ALDH1A1MAPTFBP1
SCHEMBL11047395 0.86 ALDH1A1 (0.45) KDM4ENPC1ALDH1A1MAPTFBP1
SCHEMBL11124648 0.84 KDM4E (0.41) KDM4ENPC1ALDH1A1MAPTFBP1
SCHEMBL11124612 0.84 ALDH1A1 (0.50) KDM4ENPC1ALDH1A1MAPTCA12
SCHEMBL11637413 0.84 FBP1 (0.55) KDM4ENPC1ALDH1A1MAPTFBP1
SCHEMBL11124125 0.83 GAA (0.58) KDM4ENPC1ALDH1A1MAPTGAA
SCHEMBL10888753 0.83 KDM4E (0.45) KDM4ENPC1ALDH1A1MAPTFBP1
SCHEMBL10911939 0.82 MAPT (0.48) KDM4ENPC1ALDH1A1MAPT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0044209-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-10-31 EP claimed
US-4332611-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-06-01 US claimed
EP-0044209-A1 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1982-01-20 EP claimed
EP-0044209-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-10-31 EP disclosed
US-4332611-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-06-01 US disclosed
EP-0044209-A1 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1982-01-20 EP disclosed