SCHEMBL878124

SCHEMBL878124

COC(=O)C(CCn1nnc2ccc(C)cc2c1=O)Sc1ccc(NC(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR139 Q6DWJ6 6/20 0.44
HTT P42858 1/20 0.42
RAB9A P51151 2/20 0.42
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.38
DGAT1 O75907 1/20 0.38
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL15732962 0.94 GPR139 (0.49) GPR139HTTRAB9AKMT2ALMNA
SCHEMBL877526 0.92 HTT (0.53) GPR139HTTKMT2ALMNAALDH1A1
SCHEMBL875423 0.92 GPR139 (0.45) GPR139HTTRAB9AKMT2ALMNA
SCHEMBL874668 0.89 GPR139 (0.49) GPR139RAB9AKMT2ALMNAMAPT
SCHEMBL875589 0.87 GPR139 (0.49) GPR139HTTRAB9ALMNAALDH1A1
SCHEMBL874661 0.87 CTNNB1 (0.44) GPR139HTTRAB9AKMT2ASMN1; SMN2
SCHEMBL878120 0.86 MAPT (0.46) GPR139HTTRAB9ALMNAMAPT
SCHEMBL874224 0.86 GPR139 (0.46) GPR139RAB9AKMT2ALMNAALDH1A1
SCHEMBL874885 0.85 GPR139 (0.48) GPR139HTTRAB9AKMT2ASMN1; SMN2
SCHEMBL878096 0.85 GPR139 (0.45) GPR139HTTRAB9AKMT2ALMNA

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 3 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 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 GPR139 2694/4885HTT 4338/4885RAB9A 1310/4885

“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.