SCHEMBL1949911

SCHEMBL1949911

CC1(Cc2cc(F)cc(F)c2F)C(=O)N(c2cccnc2)Cc2ccc(-c3cccc(OCC(F)(F)F)c3)cc21

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 3/20 0.37
▸ FGFR2 P21802 2/20 0.37
▸ FGFR4 P22455 2/20 0.37
▸ FGFR3 P22607 2/20 0.37
▸ BACE1 P56817 2/20 0.37
▸ SLC5A1 P13866 8/20 0.34
▸ TEK Q02763 1/20 0.33
▸ DGAT2 Q96PD7 1/20 0.33
▸ MCHR1 Q99705 2/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ GRM2 Q14416 1/20 0.32
▸ PIK3CG P48736 1/20 0.31
▸ SNRNP200 O75643 1/20 0.31

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
SCHEMBL1952153 0.92 BACE1 (0.38) FGFR1FGFR2FGFR4FGFR3BACE1
SCHEMBL1948971 0.89 BACE1 (0.40) FGFR1FGFR2FGFR4FGFR3BACE1
SCHEMBL1951996 0.87 BACE1 (0.37) FGFR1FGFR2FGFR4FGFR3BACE1
SCHEMBL1951295 0.85 BACE1 (0.39) BACE1SLC5A1DGAT2
SCHEMBL1851293 0.85 BACE1 (0.36) BACE1SLC5A1DGAT2
SCHEMBL1951745 0.84 BACE1 (0.37) BACE1SLC5A1DGAT2PIK3CG
SCHEMBL1951754 0.84 BACE1 (0.37) BACE1SLC5A1DGAT2
SCHEMBL1951609 0.83 BACE1 (0.35) BACE1SLC5A1DGAT2
SCHEMBL1949900 0.81 BACE1 (0.34) BACE1SLC5A1DGAT2
SCHEMBL1949380 0.79 BACE1 (0.36) BACE1SLC5A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110136842-A1 Substituted Dihydroisoquinolinone and Isoquinolinedione Derivatives as Calcium Channel Blockers MERCK SHARP & DOHME CORP. 2011-06-09 — — US claimed
US-20110136842-A1 Substituted Dihydroisoquinolinone and Isoquinolinedione Derivatives as Calcium Channel Blockers MERCK SHARP & DOHME CORP. 2011-06-09 — — US disclosed
US-20110136842-A1 Substituted Dihydroisoquinolinone and Isoquinolinedione Derivatives as Calcium Channel Blockers MERCK SHARP & DOHME CORP. 2011-06-09 — — US disclosed
US-20110136842-A1 Substituted Dihydroisoquinolinone and Isoquinolinedione Derivatives as Calcium Channel Blockers MERCK SHARP & DOHME CORP. 2011-06-09 — — 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-20110136842-A1 Substituted Dihydroisoquinolinone and Isoquinolinedione Derivatives as Calcium Channel Blockers CACNA1D, TRPV1, CACNA1S FGFR1 1104/4885FGFR2 1580/4885FGFR4 1772/4885

“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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