SCHEMBL939692

SCHEMBL939692

O=C(O)Cc1cc(Cl)ncc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 1/20 0.39
FABP5 Q01469 1/20 0.39
AKR1B1 P15121 1/20 0.38
CA2 P00918 1/20 0.38
CXCL8 P10145 4/20 0.38
NAPRT Q6XQN6 1/20 0.37
PTGS2 P35354 2/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.37
MAPT P10636 1/20 0.37
LMNA P02545 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PTGDR2 Q9Y5Y4 3/20 0.36
CAMK2A Q9UQM7 3/20 0.36
CYP2C9 P11712 1/20 0.36
CHRM1 P11229 1/20 0.36
AKR1B10 O60218 1/20 0.36
UGT1A9 O60656 1/20 0.36
TRPA1 O75762 1/20 0.36
ABCB11 O95342 1/20 0.36

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
SCHEMBL940270 0.85 AKR1B1 (0.38) AKR1B1CA2CXCL8NAPRTPTGS2
SCHEMBL38666455 0.81 GABRP (0.45) AKR1B1NAPRTKDM4ECYP1A2MAPT
SCHEMBL15776163 0.75 RECQL (0.42) KDM4EMAPT
SCHEMBL29411262 0.75 RECQL (0.42) KDM4EMAPT
SCHEMBL13990810 0.75 GRIN2D (0.39) PTGS2KDM4EMAPTL3MBTL1TDP1
SCHEMBL4837065 0.73 AKR1B1 (0.45) FABP4FABP5AKR1B1CA2CXCL8
SCHEMBL3738359 0.72 ABCB11 (0.41) FABP4FABP5AKR1B1CA2CXCL8
SCHEMBL29718785 0.72 ABCB11 (0.41) FABP4FABP5AKR1B1CA2CXCL8
SCHEMBL4478290 0.72 L3MBTL1 (0.47) CYP1A2MAPTLMNAL3MBTL1CYP2C9
SCHEMBL15776032 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2254416-B1 HERBICIDAL COMPOUNDS SYNGENTA LTD (GB) 2016-09-07 EP disclosed
US-8653078-B2 Herbicidal pyrido[2,3-b]pyrazines SYNGENTA LIMITED 2014-02-18 US disclosed
US-20130137574-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2013-05-30 US disclosed
US-8338598-B2 Herbicidal pyrido[2,3-B]pyrazines and their use as herbicides SYNGENTA LIMITED 2012-12-25 US disclosed
US-20110021351-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-01-27 US disclosed
EP-2254416-A2 HERBICIDAL COMPOUNDS Syngenta Limited (GB) 2010-12-01 EP disclosed
WO-2009090402-A2 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2009-07-23 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-20130137574-A1 HERBICIDAL COMPOUNDS DDT, CBR3, CBR1 FABP4 4493/4885FABP5 3707/4885AKR1B1 58/4885
US-20110021351-A1 HERBICIDAL COMPOUNDS DDT, CBR3, TH FABP4 4690/4885FABP5 4333/4885AKR1B1 195/4885

“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.