SCHEMBL6328488

SCHEMBL6328488

C#CCOc1ncc(Cl)cc1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.41
CYP2B6 P20813 1/20 0.40
MAOB P27338 5/20 0.39
EGFR P00533 2/20 0.39
MAOA P21397 3/20 0.39
RXRA P19793 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2B Q13224 1/20 0.38
TSHR P16473 2/20 0.38
LMNA P02545 1/20 0.38
CYP2C9 P11712 1/20 0.38
APEX1 P27695 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PGK1 P00558 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
HPGD P15428 1/20 0.35
PLAU P00749 1/20 0.35
SLC6A4 P31645 1/20 0.35
FPR2 P25090 2/20 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
SCHEMBL6332152 0.81 MAOB (0.39) HTTCYP2B6MAOBEGFRMAOA
SCHEMBL6327423 0.80 P2RX3 (0.38) MAOBEGFRTSHRLMNACYP2C9
SCHEMBL6830938 0.80 TSHR (0.50) HTTCYP2B6MAOBMAOATSHR
SCHEMBL2432983 0.79 SMN1; SMN2 (0.47) HTTRXRAGRIN1GRIN2BTSHR
SCHEMBL6830291 0.77 MELK (0.40) EGFRRXRAGRIN1GRIN2BTSHR
SCHEMBL6329779 0.74 CHRNB2 (0.45) EGFRRXRAGRIN1GRIN2BTSHR
SCHEMBL6339239 0.74 GRM5 (0.39) CYP2B6RXRAGRIN1GRIN2BTSHR
SCHEMBL6165930 0.73 CYP2B6 (0.36) HTTCYP2B6MAOBEGFRMAOA
SCHEMBL6815916 0.73 HPGD (0.54) HTTCYP2B6MAOBEGFRMAOA
SCHEMBL23375370 0.73 KDM4E (0.55) TSHRLMNASMN1; SMN2KMT2AMEN1

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
US-20050107437-A1 comprising pyridylalkynes used as preemergence and postemergence herbicides SYNGENTA CROP PROTECTION, INC. 2005-05-19 US disclosed
EP-1453807-A2 NOVEL HERBICIDES Syngenta Participations AG (CH) 2004-09-08 EP disclosed
US-20040102325-A1 Phenylpropynyloxypyridine herbicides SYNGENTA CROP PROTECTION, INC. 2004-05-27 US disclosed
WO-2003104206-A2 HERBICIDALLY ACTIVE HETEROCYCLYLALKYNES SYNGENTA PARTICIPATIONS AG (CH) 2003-12-18 WO disclosed
EP-1370140-A1 PHENYLPROPYNYLOXYPYRIDINE HERBICIDES Syngenta Participations AG (CH) 2003-12-17 EP disclosed
WO-2003050087-A2 NOVEL HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2003-06-19 WO disclosed
WO-2002028182-A1 PHENYLPROPYNYLOXYPYRIDINE HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2002-04-11 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-20040102325-A1 Phenylpropynyloxypyridine herbicides DDT, GSTM1, CYP4X1 HTT 234/4885CYP2B6 473/4885MAOB 2181/4885
US-20050107437-A1 comprising pyridylalkynes used as preemergence and postemergence herbicides DDT, CHRM1, CYP4X1 HTT 1226/4885CYP2B6 31/4885MAOB 1601/4885

“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.