SCHEMBL9536347

SCHEMBL9536347

C=CC[C](C=C)NC=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL168294 0.72
SCHEMBL4061442 0.70
SCHEMBL10337342 0.69
SCHEMBL8211211 0.68 TSHR (0.32)
SCHEMBL7530854 0.67 MAPT (0.41)
SCHEMBL3613613 0.67 ALDH1A1 (0.42)
SCHEMBL16833813 0.66
SCHEMBL17209859 0.61
SCHEMBL1246479 0.61
SCHEMBL16539508 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0324109-B1 6-SUBSTITUTED MITOMYCIN ANALOGS UNIVERSITY PATENTS, INC. (US) 1993-09-29 EP claimed
EP-0324109-A2 6-substituted mitomycin analogs UNIVERSITY PATENTS, INC. (US) 1989-07-19 EP claimed
WO-1989005811-A1 NEW 6-SUBSTITUTED MITOMYCIN ANALOGS UNIVERSITY PATENTS, INC. (US) 1989-06-29 WO claimed
EP-0324109-B1 6-SUBSTITUTED MITOMYCIN ANALOGS UNIVERSITY PATENTS, INC. (US) 1993-09-29 EP disclosed
US-5023253-A Antitumor agents UNIVERSITY PATENTS, INC. (US) 1991-06-11 US disclosed
US-5023253-A Antitumor agents UNIVERSITY PATENTS, INC. (US) 1991-06-11 US disclosed
EP-0324109-A2 6-substituted mitomycin analogs UNIVERSITY PATENTS, INC. (US) 1989-07-19 EP disclosed
EP-0324109-A2 6-substituted mitomycin analogs UNIVERSITY PATENTS, INC. (US) 1989-07-19 EP disclosed
WO-1989005811-A1 NEW 6-SUBSTITUTED MITOMYCIN ANALOGS UNIVERSITY PATENTS, INC. (US) 1989-06-29 WO disclosed
WO-1989005811-A1 NEW 6-SUBSTITUTED MITOMYCIN ANALOGS UNIVERSITY PATENTS, INC. (US) 1989-06-29 WO disclosed