SCHEMBL4686152

SCHEMBL4686152

CC1(C)CCc2nc(-n3cnc(-c4cc(-c5cccnc5)nc(-c5cccc(F)c5)c4)c3)ccc2C1=O

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.36
ROS1 P08922 1/20 0.36
MAPKAPK2 P49137 2/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
HSP90AA1 P07900 7/20 0.35
CYP2E1 P05181 2/20 0.35
CYP2A6 P11509 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2B6 P20813 2/20 0.35
CYP2C19 P33261 2/20 0.35
CYP3A4 P08684 1/20 0.34
PIM1 P11309 2/20 0.33
WNT1 P04628 1/20 0.33
CYP19A1 P11511 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
SCHEMBL4683088 0.94 GRM5 (0.37) GRM5MAPKAPK2PIM1
SCHEMBL4679372 0.92 GRM5 (0.40) GRM5MAPKAPK2CYP2C9CYP2C19CYP3A4
SCHEMBL4686025 0.91 GRM5 (0.40) GRM5ROS1CYP11B1CYP11B2HSP90AA1
SCHEMBL4683613 0.88 GRM5 (0.37) GRM5ROS1MAPKAPK2CYP11B1CYP11B2
SCHEMBL4736631 0.83 GRM5 (0.34) GRM5MAPKAPK2HSP90AA1
SCHEMBL4684250 0.81 GRM5 (0.40) GRM5HSP90AA1
SCHEMBL4737979 0.81 GRM5 (0.38) GRM5MAPKAPK2CYP11B2HSP90AA1PIM1
SCHEMBL8248263 0.80 GRM5 (0.40) GRM5CYP11B2
SCHEMBL4680870 0.78 GRM5 (0.41) GRM5CYP11B1CYP11B2HSP90AA1CYP2E1
SCHEMBL4686336 0.78 CYP11B2 (0.40) GRM5CYP11B2

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
EP-1943247-A1 TETRAHYDROQUINOLINONES AND THEIR USE AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Merz Pharma GmbH & Co.KGaA (DE) 2008-07-16 EP claimed
WO-2007023245-A1 TETRAHYDROQUINOLINONES AND THEIR USE AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS MERZ PHARMA GMBH & CO. KGAA (DE) 2007-03-01 WO claimed
US-20060004001-A1 Tetrahydroquinolones and their use as modulators of metabotropic glutamate receptors MERZ PHARMA GMBH & CO., KGAA (DE) 2006-01-05 US claimed
EP-1943247-A1 TETRAHYDROQUINOLINONES AND THEIR USE AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Merz Pharma GmbH & Co.KGaA (DE) 2008-07-16 EP disclosed
WO-2007023245-A1 TETRAHYDROQUINOLINONES AND THEIR USE AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS MERZ PHARMA GMBH & CO. KGAA (DE) 2007-03-01 WO disclosed
US-20060004001-A1 Tetrahydroquinolones and their use as modulators of metabotropic glutamate receptors MERZ PHARMA GMBH & CO., KGAA (DE) 2006-01-05 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 (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-20060004001-A1 Tetrahydroquinolones and their use as modulators of metabotropic glutamate receptors GRM1, GRM5, GRM2 GRM5 2/4885ROS1 3473/4885MAPKAPK2 1926/4885

“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.