SCHEMBL7686539

SCHEMBL7686539

COCCSC(=O)NC(CC(=O)O)C(=O)Cn1nnc(Sc2c(Cl)cccc2Cl)n1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSA P10619 5/20 0.34
RECQL P46063 1/20 0.34
CASP3 P42574 2/20 0.34
CASP6 P55212 1/20 0.34
CASP8 Q14790 1/20 0.34
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 3/20 0.33
LMNA P02545 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
THRB P10828 1/20 0.32
TP53 P04637 1/20 0.32
HTT P42858 2/20 0.32
PKM P14618 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL7683785 0.95 DGAT1 (0.33) CTSARECQLCASP3CASP6CASP8
SCHEMBL7679637 0.90 MAPT (0.34) CTSARECQLCASP3ALDH1A1SMN1; SMN2
SCHEMBL7684507 0.89 MTNR1A (0.33) CTSACASP3CASP6CASP8ALDH1A1
SCHEMBL7683819 0.89 ALDH1A1 (0.35) CTSAALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL7686996 0.88 CASP1 (0.39) CTSARECQLCASP3ALDH1A1SMN1; SMN2
SCHEMBL7675970 0.88 CASP1 (0.36) CTSACASP3CASP6CASP8NPC1
SCHEMBL7680229 0.87 SMN1; SMN2 (0.39) CTSARECQLALDH1A1SMN1; SMN2MAPT
SCHEMBL8177147 0.86 MEN1 (0.34) ALDH1A1SMN1; SMN2
SCHEMBL7684324 0.85 MAPT (0.36) CTSACASP3CASP6CASP8ALDH1A1
SCHEMBL7684018 0.85 CASP1 (0.37) CTSARECQLCASP3ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6136834-A TETRAZOLE PEPTIDES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US claimed
EP-0900791-A1 TETRAZOLE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 1999-03-10 EP claimed
US-6376484-B1 FOR PREVENTION AND/OR TREATMENT OF VARIOUS KINDS OF INFLAMMATORY DISEASE ONO PHARMACEUTICAL CO., LTD. (JP) 2002-04-23 US disclosed
US-6136834-A TETRAZOLE PEPTIDES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US disclosed
EP-0900791-A1 TETRAZOLE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 1999-03-10 EP disclosed