SCHEMBL16183764

SCHEMBL16183764

Cc1nc(CCNc2nc(-c3cccnc3)nc3ccc(-c4cccc(F)c4F)cc23)no1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 9/20 0.51
▸ PDE5A O76074 8/20 0.47
▸ USP1 O94782 1/20 0.43
▸ WDR48 Q8TAF3 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ HPGD P15428 1/20 0.42

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
SCHEMBL16183765 0.92 PDE5A (0.51) GBA1PDE5AUSP1WDR48POLB
SCHEMBL16183743 0.84 PDE5A (0.53) GBA1PDE5AUSP1WDR48POLB
SCHEMBL14727824 0.83 PDE5A (0.54) GBA1PDE5AUSP1WDR48POLB
SCHEMBL14727595 0.82 CYP1A2 (0.55) GBA1PDE5AUSP1WDR48ALDH1A1
SCHEMBL14475170 0.80 CYP1A2 (0.59) GBA1PDE5AUSP1WDR48POLB
SCHEMBL14474640 0.79 PDE5A (0.53) GBA1PDE5AUSP1WDR48POLB
SCHEMBL16183693 0.77 PDE5A (0.60) GBA1PDE5AUSP1WDR48POLB
SCHEMBL14474539 0.76 ABCG2 (0.57) PDE5AALDH1A1LMNAHPGD
SCHEMBL14475879 0.76 WNT1 (0.48) PDE5AUSP1WDR48ALDH1A1LMNA
SCHEMBL16183655 0.75 GBA1 (0.71) GBA1PDE5AUSP1WDR48ALDH1A1

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 GBA1 1316/4885PDE5A 704/4885USP1 2108/4885

“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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