SCHEMBL7239603

SCHEMBL7239603

Nc1ccc(S(=O)(=O)NC(Cc2ccccc2)C(=O)O)c(N)c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.57
MMP2 P08253 9/20 0.56
MMP9 P14780 7/20 0.56
ADAMTS4 O75173 1/20 0.56
POLB P06746 2/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPT P10636 1/20 0.54
ADAMTS5 Q9UNA0 1/20 0.51
MMP1 P03956 1/20 0.51
MMP3 P08254 1/20 0.51
MMP7 P09237 1/20 0.51
MMP13 P45452 1/20 0.51
CYP3A4 P08684 1/20 0.47
CYP2C19 P33261 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL7239608 1.00 HTT (0.57) HTTMMP2MMP9ADAMTS4POLB
SCHEMBL4147220 0.82 MMP2 (0.56) HTTMMP2MMP9ADAMTS4POLB
SCHEMBL27238700 0.82 MMP2 (0.56) HTTMMP2MMP9ADAMTS4POLB
SCHEMBL5148151 0.82 MMP2 (0.56) HTTMMP2MMP9ADAMTS4POLB
SCHEMBL14218257 0.78 MMP2 (0.87) MMP2MMP9ADAMTS4POLBALDH1A1
SCHEMBL6916882 0.77 MMP2 (0.63) HTTMMP2MMP9ADAMTS4POLB
SCHEMBL4188026 0.76 MMP2 (0.85) MMP2MMP9ADAMTS4POLBALDH1A1
SCHEMBL697591 0.76 MMP2 (0.85) MMP2MMP9ADAMTS4POLBALDH1A1
SCHEMBL697592 0.76 MMP2 (0.85) MMP2MMP9ADAMTS4POLBALDH1A1
SCHEMBL11950557 0.76 MMP2 (0.62) HTTMMP2MMP9ADAMTS4POLB

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-6624157-B2 Antitumor agents BRISTOL-MYERS SQUIBB COMPANY 2003-09-23 US disclosed
US-20010039273-A1 Thiadioxobenzodiazepine inhibitors of farnesyl protein transferase DING CHARLES Z (US) 2001-11-08 US disclosed
EP-0918771-A4 THIADIOXOBENZODIAZEPINE INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL MYERS SQUIBB CO (US) 2001-02-07 EP disclosed
EP-0918771-A1 THIADIOXOBENZODIAZEPINE INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 1999-06-02 EP disclosed
WO-1998002436-A1 THIADIOXOBENZODIAZEPINE INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 1998-01-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010039273-A1 Thiadioxobenzodiazepine inhibitors of farnesyl protein transferase CBR1, CBR3, FNTB HTT 4631/4885MMP2 3906/4885MMP9 3761/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.