SCHEMBL7290294

SCHEMBL7290294

O=C(N[C@H](C(=O)O)C(Nc1ccc(I)cc1)C(=O)O)C(CS)Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MME P08473 6/20 0.62
CPA3 P15088 1/20 0.50
FOLH1 Q04609 1/20 0.50

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
SCHEMBL7290297 1.00 MME (0.62) MMECPA3FOLH1
SCHEMBL7284197 0.91 MME (0.70) MMECPA3FOLH1
SCHEMBL7284178 0.91 MME (0.70) MMECPA3FOLH1
SCHEMBL7293198 0.88 MME (0.62) MMECPA3
SCHEMBL7293164 0.88 MME (0.62) MMECPA3
SCHEMBL7282431 0.88 MME (0.62) MMECPA3
SCHEMBL7282457 0.88 MME (0.62) MMECPA3
SCHEMBL7280972 0.85 MME (0.59) MME
SCHEMBL7280983 0.85 MME (0.59) MME
SCHEMBL7293308 0.85 MME (0.62) MME

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
US-5317021-A Analgesics, anticonvulsants ONO PHARMACEUTICAL CO., LTD. (JP) 1994-05-31 US claimed
EP-0341081-A2 Novel amino acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1989-11-08 EP claimed
US-5317021-A Analgesics, anticonvulsants ONO PHARMACEUTICAL CO., LTD. (JP) 1994-05-31 US disclosed