SCHEMBL4486770

SCHEMBL4486770

N#Cc1ccc([O])cc1F

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 2/20 0.57
CYP11B2 P19099 17/20 0.44
CYP11B1 P15538 15/20 0.44
DAO P14920 1/20 0.40

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
SCHEMBL4466578 0.82 TRPV4 (0.43) TRPV4CYP11B2CYP11B1
SCHEMBL3026622 0.78 MAOB (0.42) TRPV4
SCHEMBL30919072 0.76 TRPV4 (0.61) TRPV4CYP11B2CYP11B1
SCHEMBL18297999 0.76 CYP11B2 (0.67) TRPV4CYP11B2CYP11B1
SCHEMBL57346 0.76 TRPV4 (0.61) TRPV4CYP11B2CYP11B1
SCHEMBL1797379 0.74 TRPV4 (0.59) TRPV4CYP11B2CYP11B1
SCHEMBL9612021 0.74 CYP11B2 (0.68) TRPV4CYP11B2CYP11B1
SCHEMBL362787 0.73 TRPV4 (1.00) TRPV4CYP11B2CYP11B1DAO
SCHEMBL518867 0.73 TRPV4 (0.57) TRPV4CYP11B2
SCHEMBL1156401 0.73 TRPV4 (0.57) TRPV4CYP11B2CYP11B1

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
US-7517992-B2 Non-nucleoside reverse transcriptase inhibitors MEDIVIR AB (SE) 2009-04-14 US disclosed
EP-1534276-B1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2008-11-05 EP disclosed
US-20060167055-A1 Non-nucleoside reverse transcriptase inhibitors MEDIVIR AB (SE) 2006-07-27 US disclosed
EP-1534276-A2 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2005-06-01 EP disclosed
WO-2004021969-A2 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MEDIVIR AB (SE) 2004-03-18 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-20060167055-A1 Non-nucleoside reverse transcriptase inhibitors POLR2H, POLR2E, POLR1E TRPV4 4872/4885CYP11B2 3176/4885CYP11B1 2815/4885

“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.