SCHEMBL1676875

SCHEMBL1676875

COC(=O)c1cccc(-c2ccc(C=Cc3nc(-c4ccc(Cl)cc4Cl)cn3Cc3ccc(NS(C)(=O)=O)cc3)cc2)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLAU P00749 3/20 0.41
DRD2 P14416 1/20 0.40
PLAT P00750 1/20 0.40
POLB P06746 2/20 0.38
MAPT P10636 1/20 0.38
DHFR P00374 1/20 0.37
SLC2A2 P11168 6/20 0.37
P2RX3 P56373 1/20 0.37
FNTA P49354 2/20 0.36
FNTB P49356 2/20 0.36
PGGT1B P53609 1/20 0.35
MGLL Q99685 1/20 0.35
HSD17B3 P37058 1/20 0.35

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
SCHEMBL1676873 1.00 PLAU (0.41) PLAUDRD2PLATPOLBMAPT
SCHEMBL1481774 0.93 DRD2 (0.44) PLAUDRD2POLBMAPTSLC2A2
SCHEMBL1481778 0.93 DRD2 (0.44) PLAUDRD2POLBMAPTSLC2A2
SCHEMBL1482037 0.93 DRD2 (0.43) PLAUDRD2POLBMAPTSLC2A2
SCHEMBL1482034 0.93 DRD2 (0.43) PLAUDRD2POLBMAPTSLC2A2
SCHEMBL1676240 0.93 SLC2A2 (0.37) POLBSLC2A2
SCHEMBL1676235 0.93 SLC2A2 (0.37) POLBSLC2A2
SCHEMBL1482394 0.91 DRD2 (0.48) PLAUDRD2POLBMAPTDHFR
SCHEMBL1482391 0.91 DRD2 (0.48) PLAUDRD2POLBMAPTDHFR
SCHEMBL1480570 0.90 DRD2 (0.42) PLAUDRD2POLBMAPTSLC2A2

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-20110092553-A1 Substituted Azole Derivatives, Compositions, and Methods of Use TRANSTECH PHARMA, INC. (US) 2011-04-21 US disclosed
EP-1730118-A1 SUBSTITUTED AZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE Transtech Pharma, Inc. (US) 2006-12-13 EP disclosed
WO-2005080346-A1 SUBSTITUTED AZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE TRANSTECH PHARMA, INC. (US) 2005-09-01 WO disclosed
US-20050187277-A1 Substituted azole derivatives, compositions, and methods of use TRANSTECH PHARMA, INC. 2005-08-25 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 (2 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-20110092553-A1 Substituted Azole Derivatives, Compositions, and Methods of Use PTPRO, PTPN5, PTPRE PLAU 3307/4885DRD2 4873/4885PLAT 2064/4885
US-20050187277-A1 Substituted azole derivatives, compositions, and methods of use PTPRO, PTPN5, PTPRE PLAU 3307/4885DRD2 4873/4885PLAT 2064/4885

“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.