SCHEMBL4477944

SCHEMBL4477944

Ic1cccc2ccc(OCc3ccccc3)cc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.65
CYP3A4 P08684 1/20 0.54
PLAU P00749 1/20 0.50
PLAT P00750 1/20 0.50
MRGPRX4 Q96LA9 1/20 0.50
MAOB P27338 7/20 0.49
IP6K1 Q92551 1/20 0.48
MAOA P21397 2/20 0.48
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA3 P07451 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
CA7 P43166 1/20 0.48
MTNR1A P48039 1/20 0.48
KMT2A Q03164 1/20 0.48
CA9 Q16790 1/20 0.48

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
SCHEMBL10606515 0.83 ALOX5 (0.67) ALOX5CYP3A4PLAUPLATMRGPRX4
SCHEMBL22703560 0.81 ALOX5 (0.65) ALOX5CYP3A4PLAUPLATMRGPRX4
SCHEMBL4079350 0.81 ALOX5 (0.65) ALOX5CYP3A4PLAUPLATMRGPRX4
SCHEMBL38662923 0.81 ALOX5 (0.65) ALOX5CYP3A4PLAUPLATMRGPRX4
SCHEMBL51460 0.79 ALOX5 (1.00) ALOX5CYP3A4MRGPRX4MAOBMAOA
SCHEMBL28662350 0.78 ALOX5 (0.89) ALOX5CYP3A4MRGPRX4MAOBMAOA
SCHEMBL6414966 0.78 MRGPRX4 (0.60) ALOX5PLAUPLATMRGPRX4MAOB
SCHEMBL22703183 0.78 ALOX5 (0.59) ALOX5CYP3A4PLAUPLATMRGPRX4
SCHEMBL4483973 0.78 ALOX5 (0.59) ALOX5CYP3A4PLAUPLATMRGPRX4
SCHEMBL9127192 0.77 ALOX5 (0.73) ALOX5CYP3A4MRGPRX4MAOBMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090258910-A1 benzo[1,3]dioxol-5-yl-carbamic acid 6-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-naphthalen-2-yl ester and benzo[1,3]dioxol-5-yl-carbamic acid 8-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-naphthalen-2-yl ester; IRM LLC (BM) 2009-10-15 US disclosed
US-7569593-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2009-08-04 US disclosed
CN-100455579-C Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2009-01-28 CN disclosed
EP-1670780-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-12-17 EP disclosed
CN-1860111-A Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2006-11-08 CN disclosed
EP-1670780-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-06-21 EP disclosed
US-20050209285-A1 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2005-09-22 US disclosed
WO-2005030151-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (US) 2005-04-07 WO disclosed
EP-1090012-A4 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2005-04-06 EP disclosed
US-6562823-B1 Inhibition of farnesyl-protein transferase has been shown to block the growth of Ras-transformed cells in soft agar MERCK & CO., INC. 2003-05-13 US disclosed
EP-1090012-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2001-04-11 EP disclosed
WO-2000001702-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2000-01-13 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 (2 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-20090258910-A1 benzo[1,3]dioxol-5-yl-carbamic acid 6-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-naphthalen-2-yl ester and benzo[1,3]dioxol-5-yl-carbamic acid 8-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-naphthalen-2-yl ester; PDGFRA, RAF1, FLT1 ALOX5 3539/4885CYP3A4 2880/4885PLAU 3885/4885
US-20050209285-A1 Compounds and compositions as protein kinase inhibitors LCK, RAF1, MAP3K1 ALOX5 4262/4885CYP3A4 3534/4885PLAU 3662/4885

“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.