SCHEMBL14474686

SCHEMBL14474686

CCOc1cc(-c2cccc(F)c2F)cc2c(NC)nc(-c3ccncn3)nc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 3/20 0.37
▸ KLKB1 P03952 1/20 0.34
▸ FGFR1 P11362 1/20 0.33
▸ FGFR2 P21802 1/20 0.33
▸ EGFR P00533 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ S1PR1 P21453 1/20 0.32
▸ S1PR3 Q99500 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ GRM5 P41594 4/20 0.32

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
SCHEMBL14475269 0.93 KDM4E (0.35) SCN9AEGFRKDM4ESMN1; SMN2HSD17B10
SCHEMBL14474676 0.91 SCN9A (0.43) SCN9AKDM4ESMN1; SMN2HSD17B10ALDH1A1
SCHEMBL14474689 0.89 FFAR1 (0.43) KDM4ESMN1; SMN2S1PR1LMNAGRM5
SCHEMBL16185145 0.88 GRM5 (0.35) KLKB1FGFR1FGFR2S1PR1S1PR3
SCHEMBL16185146 0.87 GRM5 (0.42) SCN9AKLKB1FGFR1FGFR2EGFR
SCHEMBL14474679 0.87 KLKB1 (0.37) SCN9AKLKB1FGFR1FGFR2KDM4E
SCHEMBL16185156 0.86 CHRNA7 (0.38) SCN9AEGFRKDM4ESMN1; SMN2HSD17B10
SCHEMBL16185149 0.86 CHRNA7 (0.38) SCN9AKLKB1EGFRSMN1; SMN2LMNA
SCHEMBL14474675 0.86 KLKB1 (0.34) SCN9AKLKB1FGFR1FGFR2EGFR
SCHEMBL14474191 0.85 GRM5 (0.44) SCN9AEGFRLMNACYP3A4GRM5

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 3 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
WO-2013003586-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-03 — — WO 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 SCN9A 3217/4885KLKB1 1830/4885FGFR1 1609/4885

“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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