SCHEMBL6161416

SCHEMBL6161416

Fc1[c][nH]c2cccc(F)c12

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.41
GPR84 Q9NQS5 1/20 0.41
HTR2A P28223 3/20 0.38
FEN1 P39748 1/20 0.37
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
DAO P14920 2/20 0.32
PARP1 P09874 2/20 0.32
DDO Q99489 1/20 0.31

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
SCHEMBL2073636 0.79 FFAR1 (0.39) FFAR1GPR84HTR2AFEN1HTR2C
SCHEMBL12836459 0.69 FEN1 (0.52) FFAR1GPR84HTR2AFEN1HTR2C
SCHEMBL2073631 0.68 ALDH1A1 (0.40) GPR84PARP1
SCHEMBL442418 0.62 DAO (0.39) FFAR1GPR84HTR2AFEN1DAO
SCHEMBL26693247 0.62 FEN1 (0.46) FFAR1GPR84HTR2AFEN1HTR2C
SCHEMBL1850720 0.61 GPR84 (0.41) GPR84HTR2ADAOPARP1DDO
SCHEMBL29879228 0.61 IMPDH2 (0.59) FEN1PARP1
SCHEMBL6160406 0.61 CYP2A6 (0.39) FEN1
SCHEMBL2379988 0.61 GPR84 (0.41) GPR84FEN1
SCHEMBL12836461 0.61 IMPDH2 (0.59) FEN1PARP1

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-1341766-B1 IMIDAZOLONE DERIVATIVES FOR THE TREATMENT OF VIRAL DISEASES HOFFMANN LA ROCHE (CH) 2005-10-26 EP disclosed
EP-1341766-A1 IMIDAZOLONE DERIVATIVES FOR THE TREATMENT OF VIRAL DISEASES F. HOFFMANN-LA ROCHE AG (CH) 2003-09-10 EP disclosed
US-6518293-B2 Inhibitors of the human immunodeficiency virus reverse transcriptase enzyme which is involved in viral replication. HOFFMANN-LA ROCHE INC. 2003-02-11 US disclosed
US-20020107272-A1 Anti-HIV imidazolone derivatives F. HOFFMANN-LA ROCHE AG (CH) 2002-08-08 US disclosed
WO-2002042279-A1 IMIDAZOLONE DERIVATIVES FOR THE TREATMENT OF VIRAL DISEASES F. HOFFMANN-LA ROCHE AG (CH) 2002-05-30 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-20020107272-A1 Anti-HIV imidazolone derivatives EIF2AK2, IMPDH1, POLR2E FFAR1 4834/4885GPR84 3532/4885HTR2A 4709/4885

“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.