SCHEMBL16184733

SCHEMBL16184733

COCCN(C)c1nc(-c2cccnc2)nc2c(OC)cc(-c3ccc(F)cc3)cc12

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 14/20 0.56
▸ MAPT P10636 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ ADRB2 P07550 1/20 0.41
▸ PDE2A O00408 3/20 0.40
▸ PDE5A O76074 3/20 0.40
▸ PDE11A Q9HCR9 3/20 0.40
▸ PDE10A Q9Y233 3/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL16184798 0.94 GBA1 (0.55) GBA1MAPTALDH1A1SMN1; SMN2ADRB2
SCHEMBL16184723 0.92 GBA1 (0.53) GBA1MAPTALDH1A1SMN1; SMN2ADRB2
SCHEMBL16184814 0.91 GBA1 (0.52) GBA1MAPTALDH1A1SMN1; SMN2ADRB2
SCHEMBL16184782 0.89 GBA1 (0.53) GBA1MAPTALDH1A1SMN1; SMN2ADRB2
SCHEMBL16184765 0.89 GBA1 (0.53) GBA1MAPTALDH1A1SMN1; SMN2ADRB2
SCHEMBL16184731 0.88 ALDH1A1 (0.49) GBA1MAPTALDH1A1SMN1; SMN2PDE2A
SCHEMBL16184699 0.87 GBA1 (0.54) GBA1MAPTALDH1A1SMN1; SMN2ADRB2
SCHEMBL16184750 0.86 GBA1 (0.51) GBA1MAPTALDH1A1SMN1; SMN2ADRB2
SCHEMBL16184532 0.82 CYP1A2 (0.49) GBA1ALDH1A1PDE2APDE5APDE11A
SCHEMBL16184796 0.81 ALDH1A1 (0.50) GBA1MAPTALDH1A1SMN1; SMN2PDE2A

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 1316/4885MAPT 509/4885ALDH1A1 1687/4885

“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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