SCHEMBL4054790

SCHEMBL4054790

OCCCOc1c(Cl)cc(O)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CYP3A4 P08684 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
PLAU P00749 2/20 0.41
MAPT P10636 2/20 0.37
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
POLH Q9Y253 1/20 0.36
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
S1PR2 O95136 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
LPAR2 Q9HBW0 1/20 0.32

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
SCHEMBL4038561 0.94 PLAU (0.40) HPGDHSD17B10CYP3A4CRHBPCRHR2
SCHEMBL2448020 0.89 HSD17B10 (0.42) HPGDHSD17B10CYP3A4CRHBPCRHR2
SCHEMBL11239759 0.87 HPGD (0.44) HPGDHSD17B10CYP3A4CRHBPCRHR2
SCHEMBL8408841 0.83 MAPT (0.42) HPGDHSD17B10CYP3A4CRHBPCRHR2
SCHEMBL8408517 0.82 HPGD (0.46) HPGDHSD17B10CYP3A4CRHBPCRHR2
SCHEMBL2376058 0.82 MAPT (0.54) HPGDCYP3A4PLAUMAPTMAPK1
SCHEMBL11705523 0.82 PLAU (0.43) HPGDCYP3A4PLAUMAPTMAPK1
SCHEMBL8406353 0.82 PLAU (0.40) HPGDHSD17B10CYP3A4CRHBPCRHR2
SCHEMBL8405926 0.82 PLAU (0.40) HPGDHSD17B10CYP3A4CRHBPCRHR2
SCHEMBL8407169 0.81 HPGD (0.40) HPGDHSD17B10CYP3A4CRHBPCRHR2

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
EP-1620093-B1 PESTICIDAL (DIHALOPROPENYL) PHENYLALKYL SUBSTITUTED BENZOXAZOLE AND BENZOTHIAZOLE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2009-06-24 EP disclosed
EP-1620093-B1 PESTICIDAL (DIHALOPROPENYL) PHENYLALKYL SUBSTITUTED BENZOXAZOLE AND BENZOTHIAZOLE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2009-06-24 EP disclosed
EP-1620093-A4 PESTICIDAL (DIHALOPROPENYL) PHENYLALKYL SUBSTITUTED BENZOXAZOLE AND BENZOTHIAZOLE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2007-10-31 EP disclosed
US-7208450-B2 Pesticidal (dihalopropenyl) phenylalkyl substituted benzoxazole and benzothiazole derivatives BAYER CROPSCIENCE AG (DE) 2007-04-24 US disclosed
US-7208450-B2 Pesticidal (dihalopropenyl) phenylalkyl substituted benzoxazole and benzothiazole derivatives BAYER CROPSCIENCE AG (DE) 2007-04-24 US disclosed
US-7208450-B2 Pesticidal (dihalopropenyl) phenylalkyl substituted benzoxazole and benzothiazole derivatives BAYER CROPSCIENCE AG (DE) 2007-04-24 US disclosed
EP-1620093-A2 PESTICIDAL (DIHALOPROPENYL) PHENYLALKYL SUBSTITUTED BENZOXAZOLE AND BENZOTHIAZOLE DERIVATIVES FMC CORPORATION (US) 2006-02-01 EP disclosed
US-20050171356-A1 Pesticidal (dihalopropenyl) phenylalkyl substituted benzoxazole and benzothiazole derivatives FMC CORPORATION 2005-08-04 US disclosed
WO-2004099105-A2 PESTICIDAL (DIHALOPROPENYL) PHENYLALKYL SUBSTITUTED BENZOXAZOLE AND BENZOTHIAZOLE DERIVATIVES FMC CORPORATION (US) 2004-11-18 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-20050171356-A1 Pesticidal (dihalopropenyl) phenylalkyl substituted benzoxazole and benzothiazole derivatives DDT, PDHX, CYP4X1 HPGD 2807/4885HSD17B10 1488/4885CYP3A4 591/4885

“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.