SCHEMBL16183736

SCHEMBL16183736

Fc1cccc(-c2ccc3nc(-c4cccnc4)nc(NC4CCCCC4)c3c2)c1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 15/20 0.69
▸ ABCG2 Q9UNQ0 1/20 0.53
▸ PDE5A O76074 4/20 0.53
▸ ACP1 P24666 2/20 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
SCHEMBL14727822 0.89 GBA1 (0.64) GBA1PDE5AACP1
SCHEMBL14727827 0.87 GBA1 (0.65) GBA1PDE5AACP1
SCHEMBL14475595 0.84 GBA1 (0.64) GBA1ABCG2
SCHEMBL16184509 0.82 GBA1 (0.53) GBA1ABCG2
SCHEMBL14475591 0.82 GBA1 (0.64) GBA1ABCG2
SCHEMBL14475068 0.82 CYP1A2 (0.64) GBA1ABCG2PDE5A
SCHEMBL15966672 0.82 GBA1 (1.00) GBA1PDE5AACP1
SCHEMBL18353968 0.82 GBA1 (1.00) GBA1PDE5AACP1
SCHEMBL18353876 0.82 GBA1 (1.00) GBA1PDE5AACP1
SCHEMBL14475181 0.81 MEN1 (0.58) GBA1ABCG2PDE5AACP1

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 1316/4885ABCG2 1597/4885PDE5A 704/4885

“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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