SCHEMBL10208720

SCHEMBL10208720

FC(F)Oc1cc(CNCl)ccn1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HCRTR1 O43613 1/20 0.38
▸ HCRTR2 O43614 1/20 0.38
▸ PTGES O14684 2/20 0.37
▸ LOXL2 Q9Y4K0 4/20 0.37
▸ LOX P28300 3/20 0.37
▸ KCNH3 Q9ULD8 4/20 0.34
▸ GRM2 Q14416 5/20 0.33
▸ ROCK1 Q13464 1/20 0.33
▸ PDE4A P27815 1/20 0.32
▸ UTRN P46939 1/20 0.32
▸ DAO P14920 1/20 0.32

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
SCHEMBL14925194 0.81 HCRTR1 (0.40) HCRTR1HCRTR2PTGESLOXL2LOX
SCHEMBL25229935 0.79 PTGES (0.43) HCRTR1HCRTR2PTGESLOXL2LOX
SCHEMBL30329140 0.78 RECQL (0.47) HCRTR1HCRTR2LOXL2LOXGRM2
SCHEMBL13164105 0.78 LOXL2 (0.61) HCRTR1HCRTR2LOXL2LOX
SCHEMBL4536253 0.78 HCRTR1 (0.40) HCRTR1HCRTR2PTGESLOXL2LOX
SCHEMBL1437199 0.78 RECQL (0.47) HCRTR1HCRTR2LOXL2LOXGRM2
SCHEMBL18083206 0.78 NOS3 (0.47) HCRTR1HCRTR2LOXL2LOXGRM2
SCHEMBL8179984 0.78 LOXL2 (0.61) LOXL2LOXKCNH3
SCHEMBL25880968 0.78 RECQL (0.42) HCRTR1HCRTR2PTGESLOXL2LOX
Hydrochloric Acid SCHEMBL25210344 0.77 LOXL2 (0.59) HCRTR1HCRTR2LOXL2LOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120015920-A1 HETEROBICYCLIC METALLOPROTEASE INHIBITORS ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2012-01-19 — — US disclosed
US-7795245-B2 Heterobicyclic metalloprotease inhibitors Atlantos Pharmaceuticals Holding, Inc. (US) 2010-09-14 — — US disclosed
US-20090312312-A1 Heterobicyclic Metalloprotease Inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2009-12-17 — — US disclosed
US-20090137547-A1 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. 2009-05-28 — — US disclosed
US-20070155738-A1 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS, INC. 2007-07-05 — — US disclosed
US-20070155738-A1 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS, INC. 2007-07-05 — — 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 (4 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-20090312312-A1 Heterobicyclic Metalloprotease Inhibitors MMP13, TIMP3, MMP3 HCRTR1 4100/4885HCRTR2 4014/4885PTGES 679/4885
US-20120015920-A1 HETEROBICYCLIC METALLOPROTEASE INHIBITORS MMP13, TIMP3, MMP3 HCRTR1 4100/4885HCRTR2 4014/4885PTGES 679/4885
US-20090137547-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 HCRTR1 4100/4885HCRTR2 4014/4885PTGES 679/4885
US-20070155738-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 HCRTR1 4100/4885HCRTR2 4014/4885PTGES 679/4885

“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.

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