SCHEMBL16184493

SCHEMBL16184493

COc1cc(-c2ccccc2F)cc2c(NC3CCN(CC(N)=O)CC3)nc(-c3cccnc3)nc12

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 13/20 0.46
▸ LMNA P02545 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ EHMT2 Q96KQ7 1/20 0.41
▸ EHMT1 Q9H9B1 1/20 0.41
▸ DYRK1A Q13627 1/20 0.40
▸ CYP11B1 P15538 1/20 0.40
▸ CYP11B2 P19099 1/20 0.40
▸ CCNT1 O60563 2/20 0.40
▸ CDK9 P50750 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ WHR1 P49842 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
SCHEMBL16184575 0.94 GBA1 (0.43) GBA1LMNAMAPTSMN1; SMN2POLB
SCHEMBL16184603 0.94 CCNT1 (0.44) GBA1LMNAMAPTSMN1; SMN2POLB
SCHEMBL16184634 0.94 CCNT1 (0.44) GBA1LMNAMAPTSMN1; SMN2POLB
SCHEMBL16184547 0.91 GBA1 (0.45) GBA1LMNAMAPTSMN1; SMN2POLB
SCHEMBL16184660 0.91 GBA1 (0.45) GBA1LMNAMAPTSMN1; SMN2POLB
SCHEMBL14474226 0.91 GBA1 (0.43) GBA1LMNAMAPTSMN1; SMN2POLB
SCHEMBL16184522 0.90 GBA1 (0.44) GBA1LMNAMAPTSMN1; SMN2POLB
SCHEMBL16184484 0.87 GBA1 (0.54) GBA1LMNAMAPTSMN1; SMN2POLB
SCHEMBL16184481 0.84 GBA1 (0.56) GBA1
SCHEMBL16184496 0.83 CYP1A2 (0.44) LMNAMAPTSMN1; SMN2DYRK1ACYP11B1

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 1316/4885LMNA 4832/4885MAPT 509/4885

“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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