SCHEMBL16183765

SCHEMBL16183765

Cc1nc(CNc2nc(-c3cccnc3)nc3ccc(-c4cccc(F)c4F)cc23)no1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 11/20 0.51
▸ USP1 O94782 2/20 0.48
▸ WDR48 Q8TAF3 2/20 0.48
▸ MEN1 O00255 4/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ ALDH1A1 P00352 4/20 0.47
▸ CYP1A2 P05177 4/20 0.47
▸ CYP3A4 P08684 4/20 0.47
▸ HSD17B10 Q99714 4/20 0.47
▸ CYP2D6 P10635 3/20 0.47
▸ TSHR P16473 3/20 0.47
▸ MAPK1 P28482 3/20 0.47
▸ CYP2C19 P33261 3/20 0.47
▸ USP2 O75604 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ POLB P06746 1/20 0.46

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
SCHEMBL16183764 0.92 GBA1 (0.51) PDE5AUSP1WDR48ALDH1A1LMNA
SCHEMBL14727824 0.84 PDE5A (0.54) PDE5AUSP1WDR48MEN1KMT2A
SCHEMBL14474640 0.84 PDE5A (0.53) PDE5AUSP1WDR48MEN1KMT2A
SCHEMBL16183693 0.82 PDE5A (0.60) PDE5AUSP1WDR48MEN1KMT2A
SCHEMBL16183743 0.81 PDE5A (0.53) PDE5AUSP1WDR48ALDH1A1LMNA
SCHEMBL14475170 0.81 CYP1A2 (0.59) PDE5AUSP1WDR48MEN1KMT2A
SCHEMBL14727595 0.80 CYP1A2 (0.55) PDE5AUSP1WDR48MEN1KMT2A
SCHEMBL14474634 0.78 PDE5A (0.56) PDE5AUSP1WDR48MEN1KMT2A
SCHEMBL14475879 0.77 WNT1 (0.48) PDE5AUSP1WDR48MEN1KMT2A
SCHEMBL14474577 0.77 PDE5A (0.52) PDE5AUSP1WDR48MEN1KMT2A

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 PDE5A 704/4885USP1 2108/4885WDR48 2436/4885

“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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