SCHEMBL7680229

SCHEMBL7680229

COc1ccc(CCSC(=O)NC(CC(=O)O)C(=O)Cn2nnc(Sc3c(Cl)cccc3Cl)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CTSA P10619 3/20 0.37
RECQL P46063 1/20 0.36
GPR139 Q6DWJ6 1/20 0.36
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
MMP13 P45452 1/20 0.35
IDO1 P14902 1/20 0.35
TSHR P16473 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL8177147 0.93 MEN1 (0.34) SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL7675970 0.92 CASP1 (0.36) CTSAMEN1NPC1RAB9AKMT2A
SCHEMBL7684625 0.90 CASP1 (0.34) CTSAIDO1MEN1KMT2A
SCHEMBL7677990 0.90 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1GPR139POLBMAPT
SCHEMBL7686237 0.88 RAB9A (0.35) ALDH1A1RECQLPOLBMAPTMEN1
SCHEMBL7686539 0.87 CTSA (0.34) SMN1; SMN2ALDH1A1CTSARECQLMAPT
SCHEMBL7678033 0.86 CASP1 (0.36)
SCHEMBL7679637 0.86 MAPT (0.34) SMN1; SMN2ALDH1A1CTSARECQLMAPT
SCHEMBL7679529 0.85 TP53 (0.36) SMN1; SMN2CTSAPOLBMEN1KMT2A
SCHEMBL7679414 0.85 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1CTSAGPR139IDO1

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