SCHEMBL16183302

SCHEMBL16183302

COc1ccc2nc(-c3cccnc3)nc(N3CCc4ccc(Cl)cc43)c2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.49
▸ GAA P10253 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ ABCG2 Q9UNQ0 3/20 0.45
▸ CYP19A1 P11511 1/20 0.44
▸ GBA1 P04062 1/20 0.43
▸ CYP3A4 P08684 3/20 0.43
▸ LMNA P02545 3/20 0.43
▸ CYP1A2 P05177 2/20 0.43
▸ CYP2D6 P10635 2/20 0.43
▸ CLK4 Q9HAZ1 2/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ CYP11B2 P19099 3/20 0.43
▸ CYP17A1 P05093 1/20 0.43
▸ CYP11B1 P15538 1/20 0.43
▸ EGFR P00533 2/20 0.42
▸ TUBB4A P04350 2/20 0.42
▸ TUBB P07437 2/20 0.42
▸ PDGFRB P09619 2/20 0.42
▸ TUBA3C P0DPH7 2/20 0.42

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
SCHEMBL16183306 0.93 ALDH1A1 (0.49) MAPTGAAALDH1A1ABCG2CYP19A1
SCHEMBL14726313 0.93 GAA (0.49) MAPTGAAALDH1A1ABCG2CYP19A1
SCHEMBL16183316 0.91 ALDH1A1 (0.43) MAPTGAAALDH1A1ABCG2CYP19A1
SCHEMBL16183297 0.90 MAPT (0.49) MAPTGAAALDH1A1ABCG2GBA1
SCHEMBL14358717 0.90 ABCG2 (0.55) MAPTGAAALDH1A1ABCG2GBA1
SCHEMBL14726315 0.89 MAPT (0.49) MAPTGAAALDH1A1ABCG2GBA1
SCHEMBL16183385 0.88 MAPT (0.49) MAPTGAAALDH1A1ABCG2GBA1
SCHEMBL16183312 0.86 GBA1 (0.46) MAPTGAAALDH1A1GBA1CYP3A4
SCHEMBL16183298 0.86 ALDH1A1 (0.49) MAPTGAAALDH1A1ABCG2CYP19A1
SCHEMBL14359333 0.85 ABCG2 (0.56) MAPTGAAALDH1A1ABCG2GBA1

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 MAPT 509/4885GAA 406/4885ALDH1A1 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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