SCHEMBL29508665

SCHEMBL29508665

COC(=O)c1ccc(I)cc1S(=O)(=O)NC(=O)Nc1nc(C)nc(OC)n1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.42
GAA P10253 1/20 0.40
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL733383 1.00 CDK1 (0.42) CDK1GAAALDH1A1KDM4ENPC1
SCHEMBL31392854 1.00 CDK1 (0.42) CDK1GAAALDH1A1KDM4ENPC1
SCHEMBL31376086 0.99 CDK1 (0.42) CDK1GAAALDH1A1KDM4ENPC1
SCHEMBL187358 0.99 CDK1 (0.42) CDK1GAAALDH1A1KDM4ENPC1
Iodosulfuron SCHEMBL6467038 0.96 CDK1 (0.40) CDK1GAAALDH1A1KDM4ENPC1
Iodosulfuron SCHEMBL6428400 0.95 CDK1 (0.40) CDK1GAAALDH1A1KDM4ENPC1
Iodosulfuron SCHEMBL119814 0.92 CDK1 (0.42) CDK1GAAALDH1A1KDM4ENPC1
Iodosulfuron SCHEMBL29355338 0.92 CDK1 (0.42) CDK1GAAALDH1A1KDM4ENPC1
Iodosulfuron SCHEMBL7638003 0.92 CDK1 (0.42) CDK1GAAALDH1A1KDM4ENPC1
Iodosulfuron SCHEMBL29686924 0.92 CDK1 (0.42) CDK1GAAALDH1A1KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4687448-A1 METHOD FOR CONTROLLING PARASITIC WEEDS (OROBANCHE) IN PROTOPORPHYRINOGEN OXIDASE (PPO)-INHIBITOR TOLERANT SUNFLOWER CROP BASF Agro B.V. (NL) 2026-02-11 EP disclosed
WO-2024200525-A1 METHOD FOR CONTROLLING PARASITIC WEEDS (OROBANCHE) IN PROTOPORPHYRINOGEN OXIDASE (PPO)-INHIBITOR TOLERANT SUNFLOWER CROP BASF AGRO B. V. (NL) 2024-10-03 WO disclosed
WO-2022117515-A1 COMPOSITIONS COMPRISING IODOSULFURON-METHYL AND TEHP BAYER AKTIENGESELLSCHAFT (DE) 2022-06-09 WO disclosed