SCHEMBL1284869

SCHEMBL1284869

CCOC(=O)c1cnc2cc(C(F)(F)F)c(Cl)cc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.53
PDGFRB P09619 1/20 0.44
PDGFRA P16234 1/20 0.44
ATF1 P18846 1/20 0.41
NFKB1 P19838 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
TRPV1 Q8NER1 1/20 0.40
DHODH Q02127 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
PDE6D O43924 1/20 0.39
PDE5A O76074 1/20 0.39
PDE6A P16499 1/20 0.39
PDE6G P18545 1/20 0.39

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
SCHEMBL18988146 0.92 MAOB (0.50) MAOBPDGFRBPDGFRAATF1NFKB1
SCHEMBL18988087 0.92 MAOB (0.50) MAOBPDGFRBPDGFRAATF1NFKB1
SCHEMBL18987729 0.88 MAOB (0.47) MAOBPDGFRBPDGFRACYP2C9CYP2C19
SCHEMBL1285368 0.86 MAOB (0.54) MAOBPDGFRBPDGFRACYP2C9CYP2C19
SCHEMBL18530470 0.85 MAOB (0.53) MAOBPDGFRBPDGFRACYP2C9CYP2C19
SCHEMBL18370781 0.84 MAOB (0.50) MAOBPDGFRBPDGFRACYP2C9CYP2C19
SCHEMBL18988128 0.82 MAOB (0.51) MAOBPDGFRBPDGFRACYP2C9CYP2C19
SCHEMBL1645072 0.82 EGLN1 (0.38) MAOBPDGFRBALDH1A1HPGDDHODH
SCHEMBL29619444 0.81 MAOB (0.50) MAOBPDGFRBPDGFRACYP2C9CYP2C19
SCHEMBL11391472 0.81 MAOB (0.50) MAOBPDGFRBPDGFRACYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088746-A1 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME PFIZER INC. (US) 2012-04-12 US disclosed
US-20120088746-A1 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME PFIZER INC. (US) 2012-04-12 US disclosed
WO-2008090434-A1 SUBSTITUTED N-BICYCLICALKYL BICYCLIC CARBOXYAMIDE COMPOUNDS PFIZER JAPAN INC. (JP) 2008-07-31 WO disclosed
WO-2007133637-A2 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME RENOVIS, INC. (US) 2007-11-22 WO 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-20120088746-A1 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME TRPV1, TRPA1, TRPV2 MAOB 3327/4885PDGFRB 1019/4885PDGFRA 739/4885

“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.