SCHEMBL2333508

SCHEMBL2333508

OC(c1cccnc1)c1c(-c2cccc(F)c2)csc1-c1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHB4 P54760 1/20 0.41
KCNA5 P22460 5/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP19A1 P11511 2/20 0.37
CYP17A1 P05093 1/20 0.37
TSHR P16473 1/20 0.37
SUCNR1 Q9BXA5 2/20 0.37
KCNH2 Q12809 3/20 0.36
ANO1 Q5XXA6 1/20 0.36
CYP3A4 P08684 1/20 0.36
PDE10A Q9Y233 1/20 0.36
KCND3 Q9UK17 1/20 0.35
BRAF P15056 1/20 0.35
DHPS P49366 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
SCHEMBL2331520 0.96 EPHB4 (0.39) EPHB4KCNA5SMN1; SMN2LMNAL3MBTL1
SCHEMBL2337196 0.92 SMN1; SMN2 (0.42) EPHB4KCNA5SMN1; SMN2LMNAL3MBTL1
SCHEMBL2334653 0.90 ANO1 (0.39) EPHB4KCNA5SMN1; SMN2LMNAL3MBTL1
SCHEMBL2337766 0.88 CYP19A1 (0.44) EPHB4KCNA5SMN1; SMN2LMNAL3MBTL1
SCHEMBL2331557 0.88 KCNA5 (0.45) EPHB4KCNA5SMN1; SMN2LMNAL3MBTL1
SCHEMBL2336399 0.87 EPHB4 (0.39) EPHB4KCNA5SMN1; SMN2LMNAL3MBTL1
SCHEMBL2331901 0.85 KCNA5 (0.47) EPHB4KCNA5SMN1; SMN2LMNAL3MBTL1
SCHEMBL2331512 0.85 ANO1 (0.38) EPHB4KCNA5SMN1; SMN2LMNAL3MBTL1
SCHEMBL2338349 0.84 EPHB4 (0.40) EPHB4KCNA5SMN1; SMN2LMNAL3MBTL1
SCHEMBL12207217 0.84 EPHB4 (0.53) EPHB4KCNA5SMN1; SMN2LMNAL3MBTL1

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-20110251069-A1 ISOXAZOLE DERIVATIVES FOR USE AS PLANT GROWTH REGULATORS SYNGENTA CROP PROTECTION LLC (US) 2011-10-13 US disclosed
US-20110251069-A1 ISOXAZOLE DERIVATIVES FOR USE AS PLANT GROWTH REGULATORS SYNGENTA CROP PROTECTION LLC (US) 2011-10-13 US disclosed
US-20110251069-A1 ISOXAZOLE DERIVATIVES FOR USE AS PLANT GROWTH REGULATORS SYNGENTA CROP PROTECTION LLC (US) 2011-10-13 US disclosed
EP-2358201-A2 THIOPHENE, FURAN AND PYRROLE DERIVATIVES FOR USE AS PLANT GROWTH REGULATORS Syngenta Participations AG (CH) 2011-08-24 EP disclosed
WO-2010069880-A2 THIOPHENE, FURAN AND PYRROLE DERIVATIVES FOR USE AS PLANT GROWTH REGULATORS SYNGENTA PARTICIPATIONS AG (CH) 2010-06-24 WO disclosed
US-20070244162-A1 SUBSTITUTED AROMATIC HETEROCYCLIC COMPOUNDS AS FUNGICIDES SYNGENTA LIMITED (GB) 2007-10-18 US disclosed
US-20070244162-A1 SUBSTITUTED AROMATIC HETEROCYCLIC COMPOUNDS AS FUNGICIDES SYNGENTA LIMITED (GB) 2007-10-18 US disclosed
US-20070244162-A1 SUBSTITUTED AROMATIC HETEROCYCLIC COMPOUNDS AS FUNGICIDES SYNGENTA LIMITED (GB) 2007-10-18 US disclosed
WO-2007075487-A2 SUBSTITUTED AROMATIC HETEROCYCLIC COMPOUNDS AS FUNGICIDES SYNGENTA LIMITED (GB) 2007-07-05 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-20070244162-A1 SUBSTITUTED AROMATIC HETEROCYCLIC COMPOUNDS AS FUNGICIDES NOX5, CYP3A5, API5 EPHB4 1921/4885KCNA5 431/4885SMN1; SMN2 3172/4885
US-20110251069-A1 ISOXAZOLE DERIVATIVES FOR USE AS PLANT GROWTH REGULATORS FKBP5, FKBP2, FKBP1B EPHB4 4379/4885KCNA5 3306/4885SMN1; SMN2 4879/4885

“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.