SCHEMBL2936519

SCHEMBL2936519

COc1c2ccc(C(F)(F)F)nc2cc2c(=O)oc(-c3cc(C(F)(F)F)nn3-c3ncccc3Cl)nc12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 8/20 0.34
▸ MAPT P10636 1/20 0.34
▸ DHODH Q02127 2/20 0.33
▸ PTGS1 P23219 3/20 0.33
▸ KLK7 P49862 1/20 0.33
▸ KLK14 Q9P0G3 1/20 0.33
▸ KLK5 Q9Y337 1/20 0.33
▸ ELANE P08246 1/20 0.32
▸ MAT2A P31153 4/20 0.32
▸ C1R P00736 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ THPO P40225 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ PMP22 Q01453 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
SCHEMBL536107 0.90 OPRL1 (0.34) PTGS2MAPTDHODHPTGS1MAT2A
SCHEMBL2936337 0.89 PTGS2 (0.33) PTGS2MAPTPTGS1MAT2AC1R
SCHEMBL2927349 0.83 RXRA (0.33) PTGS2MAPTDHODHPTGS1MAT2A
SCHEMBL30389696 0.82 KDM4E (0.34) PTGS2MAPTDHODHPTGS1C1R
SCHEMBL2936258 0.82 KDM4E (0.34) PTGS2MAPTDHODHPTGS1C1R
SCHEMBL12911905 0.81 KDM4E (0.35) PTGS2MAPTDHODHPTGS1ELANE
SCHEMBL950464 0.81 C1R (0.42) MAPTELANEC1RKDM4EL3MBTL1
SCHEMBL950826 0.81 KDM4E (0.36) PTGS2MAPTDHODHPTGS1C1R
SCHEMBL949711 0.81 APEX1 (0.45) PTGS2MAPTPTGS1ELANEC1R
SCHEMBL950425 0.81 KDM4E (0.37) PTGS2MAPTDHODHPTGS1ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8580785-B2 Insecticides SYNGENTA CROP PROTECTION LLC (US) 2013-11-12 — — US disclosed
US-8580785-B2 Insecticides SYNGENTA CROP PROTECTION LLC (US) 2013-11-12 — — US disclosed
US-8580785-B2 Insecticides SYNGENTA CROP PROTECTION LLC (US) 2013-11-12 — — US disclosed
EP-1919903-B1 BICYCLIC BISAMIDE DERIVATIVES AND USE THEREOF AS INSECTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-01-27 — — EP disclosed
US-20090221587-A1 NOVEL INSECTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2009-09-03 — — US disclosed
US-20090221587-A1 NOVEL INSECTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2009-09-03 — — US disclosed
US-20090221587-A1 NOVEL INSECTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2009-09-03 — — US disclosed
EP-1919903-A2 BICYCLIC BISAMIDE DERIVATIVES AND USE THEREOF AS INSECTICIDES Syngeta Participations AG (CH) 2008-05-14 — — EP disclosed
WO-2007020050-A2 BICYCLIC BISAMIDE DERIVATIVES AND USE THEREOF AS INSECTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2007-02-22 — — 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-20090221587-A1 NOVEL INSECTICIDES DDT, CYP4F11, ACHE PTGS2 3661/4885MAPT 64/4885DHODH 182/4885

“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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