SCHEMBL3302244

SCHEMBL3302244

Cc1c(CC(=O)O)c2ccc(F)cn2c1Sc1ccc(-c2nccn2C)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 11/20 0.51
HDAC4 P56524 2/20 0.34
HTR1A P08908 1/20 0.33
HTR1B P28222 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
PDK1 Q15118 1/20 0.32
ESR1 P03372 1/20 0.31
AKR1B1 P15121 1/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL3306777 0.89 PTGDR2 (0.40) PTGDR2HDAC4CYP1A2CYP3A4CYP2C9
SCHEMBL3303664 0.83 PTGDR2 (0.51) PTGDR2ALDH1A1KDM4E
SCHEMBL3303558 0.82 PTGDR2 (0.50) PTGDR2
SCHEMBL3299818 0.82 PTGDR2 (0.52) PTGDR2
SCHEMBL3299837 0.82 PTGDR2 (0.53) PTGDR2CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL3567663 0.81 PTGDR2 (0.58) PTGDR2AKR1B1
SCHEMBL3300935 0.79 PTGDR2 (0.51) PTGDR2LMNA
SCHEMBL3570130 0.79 PTGDR2 (0.56) PTGDR2CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL2770201 0.78 PTGDR2 (0.75) PTGDR2CYP1A2CYP3A4CYP2C9AKR1B1
SCHEMBL3577547 0.77 PTGDR2 (0.65) PTGDR2CYP2C9AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100093751-A1 Indolizineacetic Acids and Their Therapeutic Use as Ligands of the CRTH2 Receptor ARGENTA DISCOVERY LIMITED (GB) 2010-04-15 US disclosed
US-20100093751-A1 Indolizineacetic Acids and Their Therapeutic Use as Ligands of the CRTH2 Receptor ARGENTA DISCOVERY LIMITED (GB) 2010-04-15 US disclosed
US-20100093751-A1 Indolizineacetic Acids and Their Therapeutic Use as Ligands of the CRTH2 Receptor ARGENTA DISCOVERY LIMITED (GB) 2010-04-15 US disclosed
EP-2121686-A1 INDOLIZINEACETIC ACIDS AND THEIR THERAPEUTIC USE AS LIGANDS OF THE CRTH2 RECEPTOR Argenta Discovery Limited (GB) 2009-11-25 EP disclosed
WO-2008078069-A1 INDOLIZINEACETIC ACIDS AND THEIR THERAPEUTIC USE AS LIGANDS OF THE CRTH2 RECEPTOR ARGENTA DISCOVERY LIMITED (GB) 2008-07-03 WO disclosed
WO-2008078069-A1 INDOLIZINEACETIC ACIDS AND THEIR THERAPEUTIC USE AS LIGANDS OF THE CRTH2 RECEPTOR ARGENTA DISCOVERY LIMITED (GB) 2008-07-03 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-20100093751-A1 Indolizineacetic Acids and Their Therapeutic Use as Ligands of the CRTH2 Receptor HRH2, HRH4, HRH1 PTGDR2 168/4885HDAC4 2145/4885HTR1A 116/4885

“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.