SCHEMBL4167672

SCHEMBL4167672

O=C(O)N1CCCC[C@H]1Cc1nc2cc(C(F)(F)F)ccn2c1Cl

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RHOC P08134 1/20 0.38
RHOA P61586 1/20 0.38
OPRD1 P41143 1/20 0.37
HRH3 Q9Y5N1 8/20 0.37
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
DAGLA Q9Y4D2 4/20 0.35
ABHD6 Q9BV23 3/20 0.35
KCNH2 Q12809 2/20 0.34

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
SCHEMBL2122869 0.87 METTL3 (0.38) RHOCRHOAALDH1A1
SCHEMBL2616566 0.81 HCRTR1 (0.52)
SCHEMBL4167801 0.78 DAGLA (0.38) ALDH1A1DAGLAABHD6
SCHEMBL3496295 0.76 TDP1 (0.35) DAGLAABHD6
SCHEMBL2120243 0.74 LTA4H (0.41)
SCHEMBL2122874 0.73 HCRTR1 (0.35) ALDH1A1
SCHEMBL4167405 0.73 ALDH1A1 (0.38) ALDH1A1DAGLA
SCHEMBL4153904 0.69 MCHR1 (0.42) OPRD1HRH3ALDH1A1DAGLAABHD6
SCHEMBL4157352 0.69 MEN1 (0.40) ALDH1A1DAGLAABHD6
SCHEMBL29479439 0.69 CPT1A (0.39) OPRD1HRH3ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090022670-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-01-22 US 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-20090022670-A1 NOVEL COMPOUNDS UGT1A1, UGT2B7, ABCB1 RHOC 4569/4885RHOA 4399/4885OPRD1 8/4885

“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.