SCHEMBL2345358

SCHEMBL2345358

Cc1cc(Oc2ccc(Cl)c(C(C)(C)C)c2)c(Cl)cc1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 2/20 0.42
HTR2A P28223 4/20 0.38
SLC6A4 P31645 4/20 0.38
KCNH2 Q12809 3/20 0.38
SCN9A Q15858 3/20 0.37
MPO P05164 1/20 0.36
TPO P07202 1/20 0.36
EPX P11678 1/20 0.36
LPO P22079 1/20 0.36
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36
NR1H4 Q96RI1 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
F2 P00734 1/20 0.34
F10 P00742 1/20 0.34
ICAM1 P05362 1/20 0.33
SELE P16581 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL2334806 0.91 ESRRA (0.40) ESRRAHTR2ASLC6A4KCNH2KDM4E
SCHEMBL5179755 0.79 SCN9A (0.43) HTR2ASLC6A4KCNH2SCN9A
SCHEMBL17355907 0.79 TEAD4 (0.46) HTR2ASLC6A4KCNH2MPOTPO
SCHEMBL17351273 0.79 MAPT (0.54) HTR2ASLC6A4KCNH2SCN9AMPO
SCHEMBL2337575 0.78 TDP1 (0.44) ESRRAKDM4EPOLBNR1H4L3MBTL1
SCHEMBL17351217 0.75 L3MBTL1 (0.51) HTR2ASLC6A4KCNH2L3MBTL1F2
SCHEMBL3304400 0.74 HTR2A (0.52) HTR2ASLC6A4KCNH2MEN1KMT2A
SCHEMBL2338697 0.72 TBXA2R (0.41) ESRRAPOLBNR1H4L3MBTL1MEN1
SCHEMBL2336047 0.71 ESRRA (0.34) ESRRAHTR2ASLC6A4KCNH2SCN9A
SCHEMBL2336045 0.71 ESRRA (0.34) ESRRAHTR2ASLC6A4KCNH2SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183296-B2 Pesticide phenyloxy substituted phenylamidine derivatives BAYER CROPSCIENCE AG (DE) 2012-05-22 US disclosed
EP-1931622-B1 PHENYLOXY SUBSTITUTED PHENYLAMIDINE DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2011-08-24 EP disclosed
US-20090042994-A1 PESTICIDE PHENYLOXY SUBSTITUTED PHENYLAMIDINE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2009-02-12 US disclosed
EP-1931622-A1 PESTICIDE PHENYLOXY SUBSTITUTED PHENYLAMIDINE DERIVATIVES Bayer CropScience AG (DE) 2008-06-18 EP disclosed
WO-2007031508-A1 PESTICIDE PHENYLOXY SUBSTITUTED PHENYLAMIDINE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2007-03-22 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-20090042994-A1 PESTICIDE PHENYLOXY SUBSTITUTED PHENYLAMIDINE DERIVATIVES DDT, PFAS, PIR ESRRA 4304/4885HTR2A 3230/4885SLC6A4 2644/4885

“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.