SCHEMBL15906112

SCHEMBL15906112

COc1ccc(Cc2ccccc2CO)cc1-c1cccc(C)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.45
HPGD P15428 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.45
TSHR P16473 1/20 0.45
PDE4D Q08499 1/20 0.44
PDCD1 Q15116 2/20 0.44
CD274 Q9NZQ7 2/20 0.44
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
CASR P41180 1/20 0.41
HTR7 P34969 3/20 0.41
CTSA P10619 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
NFKB1 P19838 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL15906168 0.88 HDAC4 (0.45) TP53HPGDSMN1; SMN2LMNATSHR
SCHEMBL15906186 0.88 TP53 (0.45) TP53HPGDSMN1; SMN2LMNATSHR
SCHEMBL15906157 0.85 PDE4D (0.48) TP53HPGDSMN1; SMN2LMNATSHR
SCHEMBL8065317 0.84 PDE4D (0.47) PDE4DPDCD1CD274FFAR1HTR7
SCHEMBL15906167 0.84 PDE4D (0.47) TP53HPGDSMN1; SMN2LMNATSHR
SCHEMBL13578418 0.82 PDE4D (0.41) PDE4DPDCD1CD274HTR7CTSA
SCHEMBL15906121 0.82 PDE4D (0.47) TP53HPGDSMN1; SMN2LMNATSHR
SCHEMBL3795641 0.82 CYP19A1 (0.48) SMN1; SMN2PDE4DMEN1KMT2APOLB
SCHEMBL15906180 0.82 PDE4D (0.42) TP53HPGDSMN1; SMN2LMNATSHR
SCHEMBL15906104 0.80 PDE4B (0.46) TP53HPGDSMN1; SMN2LMNATSHR

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 TP53 4860/4885HPGD 806/4885SMN1; SMN2 869/4885

“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.