SCHEMBL16184767

SCHEMBL16184767

COc1cc(-c2ccc(F)cc2F)cc2c(N3CCN(C(C)=O)CC3)nc(-c3cccnc3)nc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 2/20 0.44
▸ MAPT P10636 3/20 0.42
▸ LMNA P02545 3/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ CYP11B1 P15538 2/20 0.41
▸ CYP17A1 P05093 1/20 0.41
▸ CYP21A2 P08686 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ CYP11B2 P19099 2/20 0.40
▸ TGFBR1 P36897 1/20 0.40
▸ ACVR1 Q04771 1/20 0.40
▸ FAAH O00519 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ CLK4 Q9HAZ1 1/20 0.39
▸ TACR3 P29371 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
SCHEMBL16184784 0.94 GBA1 (0.44) GBA1MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL16184700 0.92 GBA1 (0.47) GBA1MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL16184735 0.90 GBA1 (0.47) GBA1MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL16184755 0.90 MAPT (0.48) GBA1MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL16184047 0.90 MAPT (0.45) GBA1MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL16184717 0.90 CYP17A1 (0.47) GBA1MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL16184764 0.89 CYP1A2 (0.51) GBA1MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL16184800 0.89 CYP11B1 (0.50) GBA1MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL16184761 0.89 MAPT (0.49) GBA1MAPTLMNAKDM4ESMN1; SMN2
SCHEMBL16184754 0.89 GBA1 (0.44) GBA1MAPTLMNAKDM4ESMN1; SMN2

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 509/4885LMNA 4832/4885

“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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