SCHEMBL1690335

SCHEMBL1690335

C[C@H](Oc1ccc(Cl)cc1-c1cccc(C#N)c1)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 6/20 0.71
TSHR P16473 1/20 0.52
HTR2A P28223 1/20 0.52
HTR2C P28335 1/20 0.52
HTR2B P41595 1/20 0.52
PTGDR Q13258 1/20 0.45
EIF4EBP1 Q13541 3/20 0.42
ADAMTS4 O75173 1/20 0.41
HSD17B3 P37058 1/20 0.41
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41
CTSA P10619 2/20 0.40
SLC22A12 Q96S37 2/20 0.40
P2RX1 P51575 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
SCHEMBL4974900 0.87 PTGDR2 (0.72) PTGDR2TSHRHTR2AHTR2CHTR2B
SCHEMBL1753372 0.86 PTGDR2 (0.74) PTGDR2ADAMTS4CTSASLC22A12
SCHEMBL1753444 0.83 PTGDR2 (1.00) PTGDR2CTSA
SCHEMBL1690253 0.80 TSHR (0.53) PTGDR2TSHRHTR2AHTR2CHTR2B
SCHEMBL1690361 0.79 PTGDR2 (1.00) PTGDR2EIF4EBP1
SCHEMBL1754952 0.79 PTGDR2 (0.67) PTGDR2EIF4EBP1HSD17B3SLC22A12P2RX1
SCHEMBL2112925 0.79 PTGDR2 (0.63) PTGDR2
SCHEMBL21507991 0.73 PTGDR2 (0.50) PTGDR2HSD17B3P2RX1
SCHEMBL20255669 0.73 PTGDR2 (0.60) PTGDR2EIF4EBP1
Rac-Dichlorprop SCHEMBL9445889 0.72 TSHR (0.52) PTGDR2TSHRHTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158820-B2 Compounds ASTRAZENECA AB (SE) 2012-04-17 US claimed
US-20110166117-A1 Novel Compounds ASTRAZENECA AB (SE) 2011-07-07 US claimed
US-20060264435-A1 Novel compounds ASTRAZENECA AB (SE) 2006-11-23 US claimed
EP-1611091-B1 Substituted phenylalkanoic acid derivatives and their use for respiratory disease treatment ASTRAZENECA AB (SE) 2014-10-29 EP disclosed
US-8158820-B2 Compounds ASTRAZENECA AB (SE) 2012-04-17 US disclosed
US-8158820-B2 Compounds ASTRAZENECA AB (SE) 2012-04-17 US disclosed
US-20110166117-A1 Novel Compounds ASTRAZENECA AB (SE) 2011-07-07 US disclosed
US-20110166117-A1 Novel Compounds ASTRAZENECA AB (SE) 2011-07-07 US disclosed
US-20060264435-A1 Novel compounds ASTRAZENECA AB (SE) 2006-11-23 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 (2 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-20110166117-A1 Novel Compounds ADRA2C, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCAR2 PTGDR2 438/4885TSHR 2760/4885HTR2A 207/4885
US-20060264435-A1 Novel compounds ADRA2C, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCAR2 PTGDR2 438/4885TSHR 2760/4885HTR2A 207/4885

“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.