SCHEMBL14358639

SCHEMBL14358639

Fc1ccc(-c2ccc3nc(-c4cccnc4)nc(Br)c3c2)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 4/20 0.49
▸ MAPT P10636 4/20 0.46
▸ TSHR P16473 3/20 0.46
▸ MAPK1 P28482 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ CYP3A4 P08684 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ ABCG2 Q9UNQ0 1/20 0.46
▸ POLB P06746 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ CLK1 P49759 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ CYP11B1 P15538 2/20 0.42
▸ GBA1 P04062 2/20 0.41
▸ DHODH Q02127 1/20 0.41

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
SCHEMBL14475173 0.86 PDE5A (0.49) PDE5AMAPTTSHRMAPK1HSD17B10
SCHEMBL16183749 0.86 PDE5A (0.49) PDE5AMAPTTSHRMAPK1HSD17B10
SCHEMBL14358979 0.86 PDE5A (0.49) PDE5AMAPTTSHRMAPK1HSD17B10
SCHEMBL16183750 0.84 ALDH1A1 (0.58) PDE5AMAPTTSHRMAPK1HSD17B10
SCHEMBL14727603 0.84 LMNA (0.61) PDE5AMAPTTSHRMAPK1HSD17B10
SCHEMBL14475213 0.84 CYP1A2 (0.59) PDE5AMAPTTSHRMAPK1HSD17B10
SCHEMBL14727592 0.84 CYP1A2 (0.59) PDE5AMAPTTSHRMAPK1HSD17B10
SCHEMBL2155510 0.83 CCNE2 (0.58) PDE5AMAPTTSHRMAPK1HSD17B10
SCHEMBL14727609 0.83 LMNA (0.63) PDE5AMAPTTSHRMAPK1HSD17B10
SCHEMBL14358585 0.81 PDE5A (0.43) PDE5AMAPTTSHRMAPK1HSD17B10

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 6 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
US-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-10-23 — — US disclosed
EP-2726485-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE Otsuka Pharmaceutical Co., Ltd. (JP) 2014-05-07 — — EP disclosed
WO-2013003586-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-03 — — WO disclosed
WO-2013003586-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-03 — — 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-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP2CA, PPP4C, PPP3CB PDE5A 704/4885MAPT 509/4885TSHR 2280/4885

“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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