SCHEMBL15906153

SCHEMBL15906153

COc1ccc(Cc2cc(C)cc(O)c2)c(F)c1-c1cccc(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 5/20 0.38
PDE4D Q08499 2/20 0.38
CALM1 P0DP23 1/20 0.34
NR3C1 P04150 2/20 0.34
NR3C2 P08235 1/20 0.34
FFAR1 O14842 1/20 0.34
CTSA P10619 2/20 0.33
GUSB P08236 1/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP1B1 Q16678 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL3789377 0.88 PDE4D (0.39) PDE4BPDE4DCALM1NR3C1FFAR1
SCHEMBL7904582 0.88 PDE4D (0.41) PDE4BPDE4DCALM1NR3C1GUSB
SCHEMBL7911734 0.87 PDE4D (0.44) PDE4BPDE4DGUSBMAPT
SCHEMBL13578452 0.86 PDE4D (0.37) PDE4BPDE4DCALM1CTSACYP1A1
SCHEMBL3790939 0.85 CYP19A1 (0.40) PDE4BPDE4DMAPTSMN1; SMN2
SCHEMBL4326850 0.81 TAAR1 (0.47) PDE4BPDE4DNPC1MAPTTSHR
SCHEMBL3791461 0.80 PDE4D (0.44) PDE4BPDE4DNPC1MAPTTSHR
SCHEMBL3467080 0.80 PDE4B (0.42) PDE4BPDE4DNR3C1NPC1MAPT
SCHEMBL7902765 0.80 PDE4B (0.39) PDE4BPDE4DCTSA
SCHEMBL8057832 0.80 PDE4D (0.49) PDE4BPDE4DMAPT

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 PDE4B 2/4885PDE4D 7/4885CALM1 2744/4885

“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.