SCHEMBL4388489

SCHEMBL4388489

COc1cccc2ccc(CCc3ccc4cccc(OC)c4n3)nc12

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 11/20 0.79
MCHR1 Q99705 1/20 0.61
DHFR P00374 1/20 0.47
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
NQO2 P16083 2/20 0.46

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
SCHEMBL4389390 0.93 PDE10A (0.70) PDE10AMCHR1HDAC1HDAC2NQO2
SCHEMBL18682211 0.91 PDE10A (0.68) PDE10AMCHR1
SCHEMBL7509842 0.89 PDE10A (1.00) PDE10AMCHR1
SCHEMBL2840650 0.87 PDE10A (0.63) PDE10AMCHR1HDAC1HDAC2NQO2
SCHEMBL18668570 0.87 PDE10A (0.63) PDE10AMCHR1
SCHEMBL23366133 0.87 PDE10A (0.63) PDE10AMCHR1DHFRHDAC1HDAC2
SCHEMBL5928336 0.86 PDE10A (0.62) PDE10AMCHR1HDAC1HDAC2
SCHEMBL5928050 0.86 PDE10A (0.62) PDE10AMCHR1DHFRHDAC1HDAC2
SCHEMBL16151253 0.86 PDE10A (0.62) PDE10AMCHR1
SCHEMBL7453345 0.86 PDE10A (0.61) PDE10AMCHR1HDAC1HDAC2NQO2

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-20090227626-A1 NOVEL POLYQUINOLINE DERIVATIVES AND THERAPEUTIC USE THEREOF PALUMED S.A. (FR) 2009-09-10 US claimed
US-8324196-B2 Polyquinoline derivatives and the therapeutic use thereof PALUMED S.A. (FR) 2012-12-04 US disclosed
US-20120277265-A1 NOVEL POLYQUINOLINE DERIVATIVES AND THE THERAPEUTIC USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2012-11-01 US disclosed
US-8247396-B2 Polyquinoline derivatives and therapeutic use thereof PALUMED S.A. (FR) 2012-08-21 US disclosed
US-20090227626-A1 NOVEL POLYQUINOLINE DERIVATIVES AND THERAPEUTIC USE THEREOF PALUMED S.A. (FR) 2009-09-10 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 (2 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-20120277265-A1 NOVEL POLYQUINOLINE DERIVATIVES AND THE THERAPEUTIC USE THEREOF HTT, APP, PSEN1 PDE10A 2625/4885MCHR1 3521/4885DHFR 3469/4885
US-20090227626-A1 NOVEL POLYQUINOLINE DERIVATIVES AND THERAPEUTIC USE THEREOF HTT, UBQLN2, UBQLN1 PDE10A 1162/4885MCHR1 3156/4885DHFR 1426/4885

“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.