SCHEMBL15906142

SCHEMBL15906142

COc1ccc(Cn2cc(C#N)ccc2=O)cc1-c1cccc(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.42
PDE4B Q07343 2/20 0.41
AR P10275 1/20 0.41
FNTA P49354 1/20 0.40
FNTB P49356 1/20 0.40
PGGT1B P53609 1/20 0.40
MAPT P10636 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CHEK1 O14757 1/20 0.39
NEK2 P51955 1/20 0.39
LIMK1 P53667 1/20 0.39
TYRO3 Q06418 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
CTSA P10619 1/20 0.39
P2RX7 Q99572 3/20 0.38
SDHB P21912 3/20 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
SCHEMBL8062936 0.86 L3MBTL1 (0.39) L3MBTL1PDE4BARFNTAFNTB
SCHEMBL15906143 0.86 CYP11B1 (0.43) CYP11B1CYP11B2PDE4BARFNTA
SCHEMBL4336210 0.85 MAPT (0.41) L3MBTL1PDE4BFNTAFNTBMAPT
SCHEMBL15906132 0.84 PDE4B (0.43) PDE4BMAPTKDM4EMEN1KMT2A
SCHEMBL15906145 0.81 MAPT (0.46) PDE4BMAPTKDM4E
SCHEMBL15906155 0.81 MAPT (0.46) PDE4BMAPTKDM4EMEN1KMT2A
SCHEMBL15906163 0.79 MAPT (0.46) PDE4BMAPTKDM4E
SCHEMBL15906131 0.79 PDE4D (0.56) PDE4BMAPTKDM4EKMT2A
SCHEMBL4329205 0.78 DBH (0.47) L3MBTL1MAPTKDM4EP2RX7SDHB
SCHEMBL15906166 0.76 MAPT (0.44) PDE4BMAPTMEN1KMT2ACHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140301999-A1 BIARYL PDE4 INHIBITORS FOR TREATING INFLAMMATORY, CARDIOVASCULAR AND CNS DISORDERS DECODE GENETICS EHF (IS) 2014-10-09 US disclosed
US-8791267-B2 Biaryl PDE4 inhibitors for treating inflammatory, cardiovascular and CNS disorders DECODE GENETICS EHF (IS) 2014-07-29 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-20140301999-A1 BIARYL PDE4 INHIBITORS FOR TREATING INFLAMMATORY, CARDIOVASCULAR AND CNS DISORDERS PDE4A, PDE4B, PDE3B CYP11B1 70/4885CYP11B2 63/4885L3MBTL1 3346/4885

“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.