SCHEMBL3327331

SCHEMBL3327331

CCOC(=O)Cc1c(C)c(Cc2ccc3cc(F)ccc3n2)c2cc(C#N)ccn12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 1/20 0.36
PTGDR Q13258 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
TSHR P16473 2/20 0.36
MAOB P27338 2/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
PDE10A Q9Y233 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HK1 P19367 1/20 0.33
HKDC1 Q2TB90 1/20 0.33
SLC34A1 Q06495 1/20 0.33
ALOX15 P16050 1/20 0.32
MAPT P10636 3/20 0.32
NPC1 O15118 2/20 0.32

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
SCHEMBL3327259 0.90 PTGDR2 (0.42) PTGIRPTGDRPTGDR2MEN1KMT2A
SCHEMBL4636112 0.87 PTGIR (0.38) PTGIRPTGDRPTGDR2TSHRMAOB
SCHEMBL3577485 0.82 TSHR (0.38) PTGIRPTGDRPTGDR2TSHRMAOB
SCHEMBL4636883 0.76 PTGDR2 (0.44) PTGIRPTGDRPTGDR2SMN1; SMN2PDE10A
SCHEMBL4636111 0.76 MAPT (0.38) TSHRMEN1KMT2APOLBHPGD
SCHEMBL4636239 0.74 PTGDR2 (0.35) PTGDR2ALDH1A1MAPT
SCHEMBL3567666 0.72 PTGDR2 (0.42) PTGIRPTGDRPTGDR2PDE10AHDAC1
SCHEMBL3327671 0.71 MAPT (0.33) TSHRHTTSMN1; SMN2MAPT
SCHEMBL3577709 0.70 MAPT (0.39) TSHRMEN1KMT2APOLBHPGD
SCHEMBL3963643 0.70 PTGDR2 (0.42) PTGDR2MEN1KMT2APOLBSMN1; 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-20100137300-A1 Indolizine Acetic Acid Derivatives as CRTH2 Antagonists ARGENTA ORAL THERAPEUTICS LIMITED (GB) 2010-06-03 US disclosed
EP-2136804-A1 INDOLIZINE ACETIC ACID DERIVATIVES AS CRTH2 ANTAGONISTS Argenta Oral Therapeutics Limited (GB) 2009-12-30 EP disclosed
WO-2008113965-A1 INDOLIZINE ACETIC ACID DERIVATIVES AS CRTH2 ANTAGONISTS ARGENTA DISCOVERY LIMITED (GB) 2008-09-25 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-20100137300-A1 Indolizine Acetic Acid Derivatives as CRTH2 Antagonists HRH1, HRH4, HRH2 PTGIR 1666/4885PTGDR 927/4885PTGDR2 826/4885

“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.