SCHEMBL6284972

SCHEMBL6284972

Cn1nc(-c2ccc(Cl)cc2Cl)cc1OC(F)F

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.42
F2RL3 Q96RI0 1/20 0.41
CRHR1 P34998 2/20 0.38
HSP90AA1 P07900 2/20 0.38
HSP90AB1 P08238 2/20 0.38
LMNA P02545 1/20 0.38
ALPL P05186 3/20 0.37

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
SCHEMBL6320670 0.88 KMO (0.36) HSD11B1F2RL3
SCHEMBL9789795 0.82 HSD11B1 (0.46) HSD11B1CRHR1HSP90AA1HSP90AB1LMNA
SCHEMBL7501165 0.81 MAPT (0.41) LMNA
SCHEMBL7588842 0.81 L3MBTL1 (0.32)
SCHEMBL6674197 0.80 PDE4B (0.30)
SCHEMBL6691871 0.80 KMT2A (0.32) F2RL3
SCHEMBL6287494 0.80 SCN9A (0.33) HSP90AA1HSP90AB1
SCHEMBL6818668 0.76 PDE4B (0.33) CRHR1
SCHEMBL6671937 0.76 PDE2A (0.31) CRHR1
SCHEMBL6690722 0.76 F2RL3 (0.34) F2RL3CRHR1

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-6897322-B2 Method of producing 1-alkyl-3-aryl-5-difluoromethoxy-1H-pyrazoles BASF AKTIENGESELLSCHAFT (DE) 2005-05-24 US disclosed
US-6888003-B2 Method for producing 7-(pyrazole-3-yl) benzoxazoles BASF AKTIENGESELLSCHAFT (DE) 2005-05-03 US disclosed
EP-1272486-B1 METHOD FOR PRODUCING 7-(PYRAZOLE-3-YL) BENZOXAZOLES BASF AG (DE) 2004-08-11 EP 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
US-20030050477-A1 Method for producing 7-(pyrazole-3-yl) benzoxazoles BASF AKTIENGESELLSCHAFT (DE) 2003-03-13 US 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 (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-20040059128-A1 Method of producing 1-alkyl-3-aryl-5-difluoromethoxy-ih-pyrazoles CYP2E1, CYP2F1, CYP1A1 HSD11B1 77/4885F2RL3 2521/4885CRHR1 789/4885
US-20030050477-A1 Method for producing 7-(pyrazole-3-yl) benzoxazoles F7, F9, TPO HSD11B1 2263/4885F2RL3 3099/4885CRHR1 2449/4885

“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.