SCHEMBL7094091

SCHEMBL7094091

CCCc1cc(-c2ccc(C3COC(c4c(F)cccc4F)=N3)cc2)ccc1O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 0.36
TAAR1 Q96RJ0 1/20 0.35
POLB P06746 1/20 0.33
HSP90AA1 P07900 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
SCHEMBL7095190 0.82 ALDH1A1 (0.35) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL6987711 0.79 ALDH1A1 (0.38) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL83319 0.77 NPC1 (0.46) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL7091831 0.77 ALDH1A1 (0.33) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL7091813 0.76 TAAR1 (0.39) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL23178803 0.75 MAPT (0.41) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL7838090 0.75 NPC1 (0.45) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL8164187 0.75 MAPT (0.46) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL8165766 0.75 MAPT (0.46) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL9268738 0.74 NPC1 (0.38) ALOX5NPC1RAB9AALDH1A1MAPT

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
EP-0970059-B1 DISUBSTITUTED BIPHENYLOXAZOLINES BAYER CROPSCIENCE AG (DE) 2003-08-20 EP disclosed
US-20020086892-A1 For controlling animal pests, in particular: insects, arachnids and nematodes BAYER AKTIENGESELLSCHAFT (DE) 2002-07-04 US disclosed
US-6410581-B1 INSECTICIDES, MITICIDES, NEMATOCIDES BAYER AKTIENGESELLSCHAFT (DE) 2002-06-25 US disclosed
EP-0970059-A1 DISUBSTITUTED BIPHENYLOXAZOLINES BAYER AG (DE) 2000-01-12 EP disclosed
WO-1998039310-A1 DISUBSTITUTED BIPHENYLOXAZOLINES BAYER AKTIENGESELLSCHAFT (DE) 1998-09-11 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 (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-20020086892-A1 For controlling animal pests, in particular: insects, arachnids and nematodes ATXN2, HAX1, ANTXR2 ALOX5 640/4885NPC1 3730/4885RAB9A 1115/4885

“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.