SCHEMBL7675762

SCHEMBL7675762

CC(=O)NCCOC(=O)NC(CC(=O)O)C(=O)Cn1nnnc1Sc1c(Cl)cccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 6/20 0.37
GHSR Q92847 4/20 0.35
CASP3 P42574 4/20 0.33
CASP6 P55212 2/20 0.32
CASP8 Q14790 2/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPC1 O15118 1/20 0.31
KMT2A Q03164 1/20 0.31
HPGD P15428 1/20 0.31
PPARG P37231 1/20 0.31
SLC22A12 Q96S37 1/20 0.31

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
SCHEMBL7681919 0.89 CASP1 (0.38) CASP1CASP3ALDH1A1LMNASMN1; SMN2
SCHEMBL7676849 0.88 CASP1 (0.38) CASP1GHSRCASP3ALDH1A1LMNA
SCHEMBL7687093 0.88 ALDH1A1 (0.36) GHSRALDH1A1LMNANPC1KMT2A
SCHEMBL7686197 0.87 CASP1 (0.37) CASP1GHSRCASP3ALDH1A1SMN1; SMN2
SCHEMBL7679421 0.87 CASP1 (0.43) CASP1CASP3ALDH1A1KMT2A
SCHEMBL7680995 0.85 CASP1 (0.53) CASP1CASP3
SCHEMBL7683990 0.85 CASP1 (0.40) CASP1CASP3
SCHEMBL7676798 0.84 CASP1 (0.37) CASP1CASP3CASP6CASP8ALDH1A1
SCHEMBL7677095 0.84 CASP1 (0.36) CASP1GHSRCASP3
SCHEMBL7682316 0.83 CASP1 (0.41) CASP1GHSRCASP3CASP6CASP8

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