SCHEMBL16183681

SCHEMBL16183681

Fc1ccc(-c2ccc3nc(-c4cccnc4)nc(NCc4ccc(F)c(F)c4)c3c2)c(F)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 12/20 0.68
▸ POLB P06746 1/20 0.62
▸ USP1 O94782 1/20 0.54
▸ WDR48 Q8TAF3 1/20 0.54
▸ ALDH1A1 P00352 3/20 0.53
▸ CYP1A2 P05177 3/20 0.53
▸ CYP3A4 P08684 3/20 0.53
▸ CYP2D6 P10635 3/20 0.53
▸ TSHR P16473 3/20 0.53
▸ MAPK1 P28482 3/20 0.53
▸ CYP2C19 P33261 3/20 0.53
▸ HSD17B10 Q99714 3/20 0.53
▸ CLK4 Q9HAZ1 3/20 0.53
▸ MEN1 O00255 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ USP2 O75604 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ GBA1 P04062 1/20 0.53
▸ TP53 P04637 1/20 0.53
▸ PTGS1 P23219 1/20 0.53

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
SCHEMBL14474637 0.94 PDE5A (0.69) PDE5APOLBUSP1WDR48ALDH1A1
SCHEMBL16183693 0.87 PDE5A (0.60) PDE5APOLBUSP1WDR48ALDH1A1
SCHEMBL14727823 0.86 PDE5A (0.62) PDE5APOLBUSP1WDR48ALDH1A1
SCHEMBL14474100 0.85 PDE5A (0.61) PDE5APOLBALDH1A1CYP1A2CYP3A4
SCHEMBL14474498 0.85 MAPT (0.59) PDE5AALDH1A1CYP1A2CYP3A4TSHR
SCHEMBL16183680 0.85 PDE5A (0.66) PDE5APOLBUSP1WDR48ALDH1A1
SCHEMBL14474517 0.85 PDE5A (0.64) PDE5APOLBUSP1WDR48ALDH1A1
SCHEMBL14475219 0.84 PDE5A (0.60) PDE5APOLBUSP1WDR48ALDH1A1
SCHEMBL14474086 0.84 PDE5A (0.60) PDE5APOLBUSP1WDR48ALDH1A1
SCHEMBL14727714 0.84 PDE5A (0.65) PDE5APOLBUSP1WDR48ALDH1A1

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 704/4885POLB 2309/4885USP1 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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