SCHEMBL1845784

SCHEMBL1845784

O=C(O)CCn1nnc2ccccc2c1=O

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.70
MEN1 O00255 1/20 0.70
KDM4E B2RXH2 2/20 0.70
ALDH1A1 P00352 4/20 0.66
EGLN3 Q9H6Z9 1/20 0.66
SMN1; SMN2 Q16637 2/20 0.61
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
PKM P14618 1/20 0.56
NPSR1 Q6W5P4 2/20 0.55
HSD17B10 Q99714 1/20 0.55
POLB P06746 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
GAA P10253 1/20 0.54
GPR139 Q6DWJ6 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54

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
SCHEMBL874199 0.91 KDM4E (0.70) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL3380663 0.89 KDM4E (0.74) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL2988880 0.87 KMT2A (0.68) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL15203552 0.86 ALDH1A1 (0.67) KMT2AMEN1ALDH1A1SMN1; SMN2NPC1
SCHEMBL15503830 0.85 KDM4E (0.91) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL4873292 0.83 KMT2A (1.00) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL18787411 0.82 KMT2A (0.67) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL10919578 0.80 KMT2A (0.82) KMT2AMEN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL6885340 0.80 EGLN3 (1.00) KMT2AKDM4EALDH1A1EGLN3SMN1; SMN2
SCHEMBL379507 0.80 ALDH1A1 (0.71) KMT2AMEN1ALDH1A1SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8846910-B2 Matrix metalloproteinase inhibitors RANBAXY LABORATORIES LIMITED (IN) 2014-09-30 US disclosed
US-8816073-B2 Matrix metalloproteinase inhibitors RANBAXY LABORATORIES LIMITED (IN) 2014-08-26 US disclosed
US-20130302378-A1 MATRIX METALLOPROTEINASE INHIBITORS SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2013-11-14 US disclosed
US-20130295141-A1 MATRIX METALLOPROTEINASE INHIBITORS SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2013-11-07 US disclosed
US-8507670-B2 Matrix metalloproteinase inhibitors RANBAXY LABORATORIES LIMITED (IN) 2013-08-13 US disclosed
EP-2074093-B1 PROCESS FOR PREPARING MATRIX METALLOPROTEINASE INHIBITORS AND CHIRAL AUXILIARY THEREFOR RANBAXY LAB LTD (IN) 2012-10-10 EP disclosed
EP-2474531-A2 Matrix metalloproteinase inhibitors Ranbaxy Laboratories Limited (IN) 2012-07-11 EP disclosed
EP-2322507-A1 Matrix metalloproteinase inhibitors Ranbaxy Laboratories Limited (IN) 2011-05-18 EP disclosed
US-20100081610-A1 MATRIX METALLOPROTEINASE INHIBITORS SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2010-04-01 US disclosed
EP-2074093-A2 MATRIX METALLOPROTEINASE INHIBITORS Ranbaxy Laboratories Limited (IN) 2009-07-01 EP disclosed
WO-2008023336-A2 MATRIX METALLOPROTEINASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2008-02-28 WO disclosed
US-3772279-A 4-OXO-1,2,3-BENZOTRIAZINE-3-PROPIONIC ACIDS AND ESTERS SANDOZ AG 1973-11-13 US 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 (3 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-20130302378-A1 MATRIX METALLOPROTEINASE INHIBITORS MMP9, MMP8, MMP25 KMT2A 2541/4885MEN1 3336/4885KDM4E 3545/4885
US-20130295141-A1 MATRIX METALLOPROTEINASE INHIBITORS MMP9, MMP8, MMP25 KMT2A 2541/4885MEN1 3336/4885KDM4E 3545/4885
US-20100081610-A1 MATRIX METALLOPROTEINASE INHIBITORS MMP9, MMP8, MMP12 KMT2A 2765/4885MEN1 3212/4885KDM4E 3523/4885

“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.