SCHEMBL5465748

SCHEMBL5465748

CC1Oc2ccc(C(CCCCNC(=O)c3ccc(Cl)cc3)NC(=O)OC(C)(C)C)cc2NC1=S

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.37
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
P2RY2 P41231 1/20 0.34
DRD3 P35462 1/20 0.33
HSD17B10 Q99714 1/20 0.33
RAB9A P51151 1/20 0.33
UTS2R Q9UKP6 3/20 0.33
PARP1 P09874 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
RORC P51449 1/20 0.32

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
SCHEMBL5465439 0.93 DRD2 (0.36) DRD2MAPTKDM4EKMT2ANPSR1
SCHEMBL5474586 0.92 PARP1 (0.40) DRD2MAPTKDM4EKMT2ANPSR1
SCHEMBL5853907 0.91 PARP1 (0.40) DRD2MAPTKDM4EKMT2ANPSR1
SCHEMBL6304809 0.87 MAPT (0.39) DRD2MAPTKDM4EKMT2ANPSR1
SCHEMBL5473212 0.86 MAPT (0.40) MAPTKDM4EKMT2ANPSR1TDP1
SCHEMBL5472786 0.85 MAPT (0.41) MAPTKDM4EKMT2ANPSR1TDP1
SCHEMBL5467225 0.85 MAPT (0.39) MAPTKDM4EKMT2ANPSR1TDP1
SCHEMBL5464742 0.84 MAPT (0.42) MAPTKDM4EKMT2ANPSR1PARP1
SCHEMBL7092472 0.83 HSD17B10 (0.37) DRD2MAPTKMT2ANPSR1HSD17B10
SCHEMBL5464875 0.83 MAPT (0.34) MAPTKDM4EKMT2ANPSR1RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070049583-A1 Benzoxazine and benzothiazine derivatives and their use in pharmaceutical agents SCHERING AKTIENGESELLSCHAFT (DE) 2007-03-01 US disclosed
US-7141566-B1 Benzoxazine and benzothiazine derivatives and the use thereof in medicaments SCHERING AKTIENGESELLSCHAFT (DE) 2006-11-28 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 (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-20070049583-A1 Benzoxazine and benzothiazine derivatives and their use in pharmaceutical agents CYP3A5, XDH, CYP4Z1 DRD2 2978/4885MAPT 10/4885KDM4E 3444/4885

“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.