SCHEMBL5091309

SCHEMBL5091309

CCOCOc1ccc(C#N)cc1-c1cc(F)cc(F)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 5/20 0.45
FNTB P49356 3/20 0.40
FNTA P49354 2/20 0.40
TRPV4 Q9HBA0 1/20 0.38
PTGER1 P34995 2/20 0.38
KDM1A O60341 1/20 0.37
S1PR1 P21453 1/20 0.37
SYK P43405 1/20 0.36
AURKB Q96GD4 1/20 0.36
INCENP Q9NQS7 1/20 0.36
SSTR2 P30874 1/20 0.34
PGGT1B P53609 1/20 0.34
CTSA P10619 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
HRH1 P35367 1/20 0.34

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
SCHEMBL5089060 0.88 PTGDR2 (0.48) PTGDR2FNTBFNTAPTGER1PGGT1B
SCHEMBL5089110 0.85 FNTA (0.42) PTGDR2FNTBFNTATRPV4KDM1A
SCHEMBL5098821 0.85 PTGDR2 (0.44) PTGDR2FNTBFNTATRPV4PTGER1
SCHEMBL5091227 0.82 PGGT1B (0.44) PTGDR2FNTBFNTATRPV4KDM1A
SCHEMBL5098838 0.80 KCNH2 (0.43) PTGDR2FNTBFNTATRPV4KDM1A
SCHEMBL5098895 0.80 FNTB (0.54) PTGDR2FNTBFNTAKDM1APGGT1B
SCHEMBL5099574 0.79 PTGDR2 (0.53) PTGDR2FNTBFNTAPTGER1PGGT1B
SCHEMBL5094116 0.78 FNTA (0.47) PTGDR2FNTBFNTASYKPGGT1B
SCHEMBL5089214 0.77 FNTA (0.47) PTGDR2FNTBFNTATRPV4KDM1A
SCHEMBL5094188 0.77 FNTB (0.49) PTGDR2FNTBFNTAS1PR1PGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7323570-B2 Farnesyltransferase inhibitors ABBOTT LABORATORIES (US) 2008-01-29 US disclosed
US-7211595-B2 Farnesyltransferase inhibitors ABBOTT LABORATORIES (US) 2007-05-01 US disclosed
US-20060264476-A1 Farnesyltransferase Inhibitors ABBVIE INC. 2006-11-23 US disclosed
EP-1339695-B1 FARNESYLTRANSFERASE INHIBITORS ABBOTT LAB (US) 2006-04-19 EP disclosed
US-20030087940-A1 Farnesyltransferase inhibitors ABBVIE INC. 2003-05-08 US disclosed
US-20020115640-A1 Such as 4-(((6-chloro-2-(3-chlorophenyl)-3-pyridinyl) methoxy)(1-methyl-1H-imidazol-5-yl)methyl)benzonitrile; anticancer agents ABBOTT LABORATORIES 2002-08-22 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 (3 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-20020115640-A1 Such as 4-(((6-chloro-2-(3-chlorophenyl)-3-pyridinyl) methoxy)(1-methyl-1H-imidazol-5-yl)methyl)benzonitrile; anticancer agents FNTB, FNTA, ACAT2 PTGDR2 4612/4885FNTB 1/4885FNTA 2/4885
US-20060264476-A1 Farnesyltransferase Inhibitors FNTB, FNTA, FDPS PTGDR2 3285/4885FNTB 1/4885FNTA 2/4885
US-20030087940-A1 Farnesyltransferase inhibitors FNTB, FNTA, FDPS PTGDR2 3106/4885FNTB 1/4885FNTA 2/4885

“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.