SCHEMBL21028009

SCHEMBL21028009

O=C(O)C1CCc2c(Cc3cccc4c3CCS4(=O)=O)c3cc(F)ccc3n2C1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.60
TBXA2R P21731 3/20 0.40
PTGDR Q13258 2/20 0.40
SLC6A3 Q01959 1/20 0.35

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
SCHEMBL21028301 0.85 PTGDR2 (0.42) PTGDR2TBXA2RPTGDRSLC6A3
SCHEMBL21028008 0.82 PTGDR2 (0.45) PTGDR2TBXA2RPTGDRSLC6A3
SCHEMBL21027848 0.82 PTGDR2 (0.59) PTGDR2TBXA2RPTGDRSLC6A3
SCHEMBL21027880 0.82 PTGDR2 (0.59) PTGDR2TBXA2RPTGDRSLC6A3
SCHEMBL21027882 0.77 PTGDR2 (0.45) PTGDR2TBXA2RPTGDRSLC6A3
SCHEMBL21032547 0.75 PTGDR2 (1.00) PTGDR2PTGDR
SCHEMBL21027999 0.74 PTGDR2 (0.43) PTGDR2TBXA2RPTGDR
SCHEMBL21027846 0.74 PTGDR2 (0.55) PTGDR2TBXA2RPTGDR
SCHEMBL21027847 0.74 PTGDR2 (0.53) PTGDR2TBXA2RPTGDRSLC6A3
SCHEMBL21027862 0.73 PTGDR2 (0.44) PTGDR2TBXA2RPTGDRSLC6A3

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-11524958-B2 Tricyclic compound as CRTH2 inhibitor CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-12-13 US disclosed
US-20210403466-A1 TRICYCLIC COMPUND AS CRTH2 INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2021-12-30 US disclosed
EP-3489235-A1 TRICYCLIC COMPOUND AS CRTH2 INHIBITOR Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2019-05-29 EP 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-20210403466-A1 TRICYCLIC COMPUND AS CRTH2 INHIBITOR NR3C2, CRHR2, CRHR1 PTGDR2 152/4885TBXA2R 184/4885PTGDR 412/4885
US-11524958-B2 Tricyclic compound as CRTH2 inhibitor NR1H2, NR3C2, NR1H4 PTGDR2 313/4885TBXA2R 122/4885PTGDR 550/4885

“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.