SCHEMBL4679910

SCHEMBL4679910

CC1(C)CC(=O)c2ccc(-c3nn(-c4ccccc4)c(=O)n3-c3ccccc3)nc2C1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.49
ALDH1A1 P00352 7/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CYP11B2 P19099 1/20 0.41
HTT P42858 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
SRC P12931 1/20 0.41
KDM4E B2RXH2 4/20 0.40
KMT2A Q03164 1/20 0.40
POLB P06746 1/20 0.40
GRM5 P41594 1/20 0.39
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL4683140 0.81 CYP2C19 (0.48) CYP2C19ALDH1A1HPGDSMN1; SMN2CYP11B2
SCHEMBL4680781 0.81 HPGD (0.51) ALDH1A1HPGDSMN1; SMN2HTTSRC
SCHEMBL4679555 0.80 GRM5 (0.48) CYP2C19ALDH1A1HPGDSMN1; SMN2CYP11B2
SCHEMBL4682942 0.78 CYP2C19 (0.46) CYP2C19ALDH1A1HPGDSMN1; SMN2CYP11B2
SCHEMBL4683095 0.78 CYP2C19 (0.46) CYP2C19ALDH1A1HPGDSMN1; SMN2CYP11B2
SCHEMBL4739381 0.78 CYP2C19 (0.46) CYP2C19ALDH1A1HPGDSMN1; SMN2CYP11B2
SCHEMBL4741092 0.77 CYP2C19 (0.45) CYP2C19ALDH1A1HPGDSMN1; SMN2CYP11B2
SCHEMBL4683102 0.76 CYP2C19 (0.49) CYP2C19ALDH1A1HPGDSMN1; SMN2CYP11B2
SCHEMBL6103674 0.75 ALDH1A1 (0.43) CYP2C19ALDH1A1HPGDSMN1; SMN2CYP11B2
SCHEMBL11644246 0.75 CYP2C19 (0.60) CYP2C19ALDH1A1HPGDSMN1; SMN2HTT

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-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
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 CYP2C19 2841/4885ALDH1A1 3118/4885HPGD 775/4885

“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.