SCHEMBL6312767

SCHEMBL6312767

Oc1cc(-c2ccc(Cl)cc2F)n[nH]1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.46
ALPL P05186 13/20 0.44
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
MAPT P10636 3/20 0.41
HPGD P15428 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPK1 P28482 2/20 0.39
LMNA P02545 1/20 0.39
ALOX15 P16050 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 1/20 0.39
ALOX12 P18054 1/20 0.39
HTT P42858 1/20 0.39
ALPG P10696 1/20 0.38
MARS1 P56192 1/20 0.38

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
SCHEMBL14844911 0.83 ALPL (0.57) KMOALPLKMT2AMEN1MAPT
SCHEMBL6311744 0.83 ALPL (0.62) ALPLKMT2AMAPK1ALPGMARS1
SCHEMBL21775851 0.80 KMO (0.42) KMOALPLKMT2AMEN1MAPT
SCHEMBL31081444 0.77 MAPT (0.52) KMT2AMEN1MAPTHPGDSMN1; SMN2
SCHEMBL6314155 0.74 KMO (0.38) KMOALPLKMT2AMAPTMAPK1
SCHEMBL28833108 0.73 ALPL (0.59) ALPLKMT2AMEN1MAPTHPGD
SCHEMBL3846744 0.72 KMO (0.44) KMOALPLMAPK1
SCHEMBL30886929 0.72 KMO (0.40) KMOALPLMAPK1
SCHEMBL23638850 0.71 S100A4 (0.46) KMOLMNA
SCHEMBL30598347 0.71 S100A4 (0.46) KMOLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6897322-B2 Method of producing 1-alkyl-3-aryl-5-difluoromethoxy-1H-pyrazoles BASF AKTIENGESELLSCHAFT (DE) 2005-05-24 US disclosed
US-20040059128-A1 Method of producing 1-alkyl-3-aryl-5-difluoromethoxy-ih-pyrazoles BASF AKTIENGESELLSCHAFT (DE) 2004-03-25 US disclosed
EP-1358164-A1 METHOD OF PRODUCING 1-ALKYL-3-ARYL-5-DIFLUOROMETHOXY-1H-PYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 2003-11-05 EP disclosed
WO-2002055504-A1 METHOD OF PRODUCING 1-ALKYL-3-ARYL-5-DIFLUOROMETHOXY-1H-PYRAZOLES BASF AKTIENGESELLSCHAFT (DE) 2002-07-18 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-20040059128-A1 Method of producing 1-alkyl-3-aryl-5-difluoromethoxy-ih-pyrazoles CYP2E1, CYP2F1, CYP1A1 KMO 127/4885ALPL 2813/4885KMT2A 407/4885

“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.