SCHEMBL4290532

SCHEMBL4290532

NC(=O)/N=C(/NO)NCCCC[C@@H](NS(=O)(=O)c1ccc(Oc2ccc(F)cc2)cc1)C(=O)NO

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 5/20 0.50
MMP2 P08253 4/20 0.50
MMP9 P14780 4/20 0.50
ADAM10 O14672 3/20 0.50
ADAM8 P78325 3/20 0.50
MMP14 P50281 3/20 0.50
MMP12 P39900 2/20 0.50
MMP1 P03956 2/20 0.47
ADAMTS4 O75173 1/20 0.47
ADAMTS1 Q9UHI8 1/20 0.47
ADAMTS7 Q9UKP4 1/20 0.47
ADAMTS5 Q9UNA0 1/20 0.47
BMP1 P13497 12/20 0.47
MMP7 P09237 1/20 0.45
MMP13 P45452 1/20 0.43

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
SCHEMBL1799495 0.86 ADAM17 (0.47) ADAM17MMP2MMP9ADAM10ADAM8
SCHEMBL4377322 0.84 ADAM17 (0.56) ADAM17MMP2MMP9ADAM10ADAM8
SCHEMBL1802607 0.82 MMP2 (0.52) ADAM17MMP2MMP9ADAM10ADAM8
SCHEMBL1800002 0.82 ADAM17 (0.45) ADAM17MMP2MMP9ADAM10ADAM8
SCHEMBL1800964 0.81 ADAM17 (0.47) ADAM17MMP2MMP9ADAM10ADAM8
SCHEMBL1796851 0.76 ADAM17 (0.59) ADAM17MMP2MMP9ADAM10ADAM8
SCHEMBL3872450 0.76 MMP13 (0.56) ADAM17MMP2MMP9ADAM10ADAM8
SCHEMBL1800828 0.76 BMP1 (0.51) ADAM17MMP2MMP9ADAM10ADAM8
SCHEMBL1799177 0.75 BMP1 (0.58) ADAM17MMP2MMP9ADAM10ADAM8
SCHEMBL3869082 0.75 MMP2 (0.42) ADAM17MMP2MMP9ADAM10ADAM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8247451-B2 ADAM10 and its uses related to infection VANDERBILT UNIVERSITY (US) 2012-08-21 US disclosed
US-8247451-B2 ADAM10 and its uses related to infection VANDERBILT UNIVERSITY (US) 2012-08-21 US disclosed
US-8247451-B2 ADAM10 and its uses related to infection VANDERBILT UNIVERSITY (US) 2012-08-21 US disclosed
US-20090220514-A1 ADAM10 and its Uses Related to Infection VANDERBILT UNIVERSITY 2009-09-03 US disclosed
US-20090220514-A1 ADAM10 and its Uses Related to Infection VANDERBILT UNIVERSITY 2009-09-03 US disclosed
US-20090220514-A1 ADAM10 and its Uses Related to Infection VANDERBILT UNIVERSITY 2009-09-03 US disclosed
WO-2007084488-A2 ADAM10 AND ITS USES RELATED TO INFECTION VANDERBILT UNIVERSITY (US) 2007-07-26 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-20090220514-A1 ADAM10 and its Uses Related to Infection ADAM10, ADAM12, ADAM17 ADAM17 3/4885MMP2 223/4885MMP9 97/4885

“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.