SCHEMBL16184822

SCHEMBL16184822

CNC(=O)C1CN(c2nc(-c3cccnc3)nc3c(OC)cc(-c4ccc(F)c(F)c4)cc23)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ ABCB1 P08183 10/20 0.41
▸ ABCC1 P33527 5/20 0.41
▸ CYP11B1 P15538 1/20 0.39
▸ CYP11B2 P19099 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MKNK1 Q9BUB5 1/20 0.37
▸ MKNK2 Q9HBH9 1/20 0.37
▸ HTR2A P28223 1/20 0.36
▸ HTR2C P28335 1/20 0.36
▸ HTR2B P41595 1/20 0.36
▸ CHRNB2 P17787 1/20 0.36
▸ CHRNA5 P30532 1/20 0.36
▸ CHRNA4 P43681 1/20 0.36
▸ CHKA P35790 1/20 0.35
▸ GBA1 P04062 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
SCHEMBL16184738 0.92 MAPT (0.42) MAPTKDM4ELMNASMN1; SMN2ABCB1
SCHEMBL16184720 0.91 MAPT (0.40) MAPTKDM4ELMNASMN1; SMN2ABCB1
SCHEMBL16184805 0.91 MAPT (0.41) MAPTKDM4ELMNASMN1; SMN2ABCB1
SCHEMBL16184817 0.91 MAPT (0.49) MAPTKDM4ELMNASMN1; SMN2ABCB1
SCHEMBL16184787 0.89 MAPT (0.41) MAPTKDM4ELMNASMN1; SMN2ABCB1
SCHEMBL16184704 0.89 CYP11B1 (0.43) MAPTKDM4ELMNASMN1; SMN2ABCB1
SCHEMBL16184752 0.88 MAPT (0.41) MAPTKDM4ELMNASMN1; SMN2CYP11B1
SCHEMBL16184773 0.88 MAPT (0.41) MAPTKDM4ELMNASMN1; SMN2ABCB1
SCHEMBL14475241 0.86 MAPT (0.42) MAPTKDM4ELMNASMN1; SMN2ABCB1
SCHEMBL16184051 0.83 MAPT (0.46) MAPTKDM4ELMNASMN1; SMN2ABCB1

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-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-10-23 — — US disclosed
US-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-10-23 — — 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-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP2CA, PPP4C, PPP3CB MAPT 509/4885KDM4E 1395/4885LMNA 4832/4885

“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.

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