SCHEMBL3577485

SCHEMBL3577485

CCOC(=O)Cc1c(C)c(Cc2ccc3cc(F)ccc3n2)n2cc(C#N)ccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
PTGIR P43119 1/20 0.36
PTGDR Q13258 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
SLC34A1 Q06495 1/20 0.36
MAOB P27338 2/20 0.34
NPSR1 Q6W5P4 2/20 0.33
HPGD P15428 2/20 0.33
HTT P42858 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
ALDH1A1 P00352 4/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
PDE10A Q9Y233 3/20 0.33
HK1 P19367 1/20 0.33
HKDC1 Q2TB90 1/20 0.33
KDM4E B2RXH2 4/20 0.33
CYP2C9 P11712 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
SCHEMBL3567666 0.90 PTGDR2 (0.42) PTGIRPTGDRPTGDR2PDE10APDE4A
SCHEMBL3327331 0.82 PTGIR (0.36) TSHRPTGIRPTGDRPTGDR2SLC34A1
SCHEMBL3962109 0.77 PTGDR2 (0.39) TSHRPTGDR2SLC34A1NPSR1MEN1
SCHEMBL14176165 0.76 PTGDR2 (0.44) TSHRPTGIRPTGDRPTGDR2PDE10A
SCHEMBL3969206 0.76 SLC6A4 (0.37) PTGDR2NPSR1MEN1KMT2APOLB
SCHEMBL3968252 0.75 PTGDR2 (0.38) PTGDR2SLC34A1NPSR1MEN1KMT2A
SCHEMBL3972653 0.74 PTGDR2 (0.42) PTGDR2MEN1KMT2AGAAALDH1A1
SCHEMBL3969463 0.74 PTGDR2 (0.47) PTGDR2MEN1KMT2AMAPT
SCHEMBL4636112 0.73 PTGIR (0.38) TSHRPTGIRPTGDRPTGDR2MAOB
SCHEMBL3969346 0.73 MEN1 (0.32) TSHRSLC34A1MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100010034-A1 CRTH2 ANTAGONISTS ARGENTA DISCOVERY LIMITED (GB) 2010-01-14 US disclosed
EP-2094266-A1 CRTH2 ANTAGONISTS Argenta Discovery Limited (GB) 2009-09-02 EP disclosed
WO-2008074966-A1 CRTH2 ANTAGONISTS ARGENTA DISCOVERY LIMITED (GB) 2008-06-26 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-20100010034-A1 CRTH2 ANTAGONISTS HRH2, MDH2, HRH1 TSHR 309/4885PTGIR 1200/4885PTGDR 335/4885

“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.