SCHEMBL874269

SCHEMBL874269

Cc1ccc2nnn(CCC(C(=O)O)S(=O)(=O)c3ccc(NC(=O)c4ccc(Cl)cc4)cc3)c(=O)c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 3/20 0.43
TCF7L2 Q9NQB0 3/20 0.43
GPR139 Q6DWJ6 2/20 0.42
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ENPP3 O14638 1/20 0.41
ENPP1 P22413 1/20 0.41
ENPP2 Q13822 1/20 0.41
MMP2 P08253 3/20 0.40
MMP9 P14780 3/20 0.40
HTT P42858 1/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
MAPT P10636 1/20 0.39
HSD17B10 Q99714 1/20 0.39
POLB P06746 1/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL875092 0.95 GPR139 (0.44) GPR139RAB9AMEN1KMT2AMMP2
SCHEMBL878389 0.92 CTNNB1 (0.45) CTNNB1TCF7L2GPR139RAB9AHTT
SCHEMBL874946 0.92 CTNNB1 (0.43) CTNNB1TCF7L2GPR139KDM4EMEN1
SCHEMBL875236 0.91 MAPT (0.45) CTNNB1TCF7L2GPR139RAB9ANPC1
SCHEMBL874966 0.91 GPR139 (0.49) GPR139RAB9ANPC1KDM4EMEN1
SCHEMBL874819 0.89 GPR139 (0.44) GPR139RAB9AMEN1KMT2AMMP2
SCHEMBL878191 0.89 ALDH1A1 (0.49) GPR139KDM4EMEN1KMT2AMMP2
SCHEMBL875182 0.88 MMP2 (0.51) GPR139MMP2MMP9
SCHEMBL875435 0.88 GPR139 (0.49) GPR139RAB9ANPC1KDM4EMMP2
SCHEMBL874410 0.87 HTT (0.54) GPR139RAB9AKDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140148459-A1 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2014-05-29 US claimed
US-20140148459-A1 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2014-05-29 US disclosed
EP-2619185-A1 MATRIX METALLOPROTEINASE INHIBITORS Ranbaxy Laboratories Limited (IN) 2013-07-31 EP disclosed
WO-2012038942-A1 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2012-03-29 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-20140148459-A1 MATRIX METALLOPROTEINASE INHIBITORS MMP9, MMP12, MMP10 CTNNB1 2748/4885TCF7L2 3550/4885GPR139 2694/4885

“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.