SCHEMBL5188384

SCHEMBL5188384

C[C@H]1Oc2ccc(C(F)N(CCCc3ccccc3)C(=O)OC(C)(C)C)cc2N=C1N

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NAAA Q02083 1/20 0.30
LPAR1 Q92633 1/20 0.30

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
SCHEMBL5188614 0.81 PARP1 (0.46) L3MBTL1ALDH1A1HTTNAAA
SCHEMBL7710218 0.81 HTR2C (0.33) LMNAL3MBTL1ALDH1A1
SCHEMBL7704961 0.76 HDAC3 (0.33) LMNAL3MBTL1MEN1ALDH1A1KMT2A
SCHEMBL6302740 0.76 HDAC3 (0.43) NPSR1MEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL7704912 0.74 ALDH1A1 (0.45) LMNANPSR1MAPTMEN1ALDH1A1
SCHEMBL6279353 0.73
SCHEMBL5188660 0.72 SSTR4 (0.32)
SCHEMBL5189245 0.72 SSTR4 (0.32)
Hydrochloric Acid SCHEMBL6279110 0.72 SIGMAR1 (0.35) MEN1KMT2A
Hydrochloric Acid SCHEMBL5188650 0.72 SIGMAR1 (0.35) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1282610-B1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND THE USE THEREOF IN MEDICAMENTS BAYER SCHERING PHARMA AG (DE) 2007-07-25 EP disclosed
US-6914059-B2 Benzoxazine and benzothiazine derivatives and the use thereof in medicaments SCHERING AG (DE) 2005-07-05 US disclosed
US-20040006075-A1 Benzoxazine and benzothiazine derivatives and the use thereof in medicaments SCHERING AG (DE) 2004-01-08 US disclosed
EP-1282610-A1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND THE USE THEREOF IN MEDICAMENTS Schering Aktiengesellschaft (DE) 2003-02-12 EP disclosed
WO-2001081323-A1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND THE USE THEREOF IN MEDICAMENTS SCHERING AKTIENGESELLSCHAFT (DE) 2001-11-01 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-20040006075-A1 Benzoxazine and benzothiazine derivatives and the use thereof in medicaments CYP4Z1, XDH, CYP3A5 LMNA 1425/4885NPSR1 1903/4885MAPT 11/4885

“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.