SCHEMBL7243200

SCHEMBL7243200

CO[C@@H]1CC(=O)[C@H](CC=CCCCC(=O)O)[C@H]1C=CCC(O)C1(Cc2ccc(Cl)s2)CCC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 7/20 0.45
PTGER2 P43116 6/20 0.45
PTGER3 P43115 4/20 0.42
PTGER4 P35408 3/20 0.42
PTGER1 P34995 2/20 0.42
PTGFR P43088 2/20 0.42
NR1I2 O75469 1/20 0.41
ESR1 P03372 1/20 0.41
PGR P06401 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
TBXA2R P21731 1/20 0.41
MAPK1 P28482 1/20 0.41
OPRK1 P41145 1/20 0.41
PDE4D Q08499 1/20 0.41

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
SCHEMBL7243195 1.00 PTGIR (0.45) PTGIRPTGER2PTGER3PTGER4PTGER1
SCHEMBL7246260 0.94 PTGIR (0.46) PTGIRPTGER2PTGER3PTGER4PTGER1
SCHEMBL7688563 0.94 PTGIR (0.46) PTGIRPTGER2PTGER3PTGER4PTGER1
SCHEMBL7246257 0.94 PTGIR (0.46) PTGIRPTGER2PTGER3PTGER4PTGER1
SCHEMBL7246076 0.93 PTGER3 (0.40) PTGIRPTGER2PTGER3PTGER4PTGER1
SCHEMBL7246072 0.93 PTGER3 (0.40) PTGIRPTGER2PTGER3PTGER4PTGER1
SCHEMBL7242425 0.90 PTGIR (0.53) PTGIRPTGER2PTGER3PTGER4PTGER1
SCHEMBL7242419 0.90 PTGIR (0.53) PTGIRPTGER2PTGER3PTGER4PTGER1
SCHEMBL7243445 0.86 PTGIR (0.40) PTGIRPTGER2PTGER3PTGER4PTGER1
SCHEMBL7243443 0.86 PTGIR (0.40) PTGIRPTGER2PTGER3PTGER4PTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6586462-B2 ω-Cycloalkyl 17-heteroaryl prostaglandin E2 analogs as EP2-receptor agonists ALLERGAN, INC. 2003-07-01 US claimed
US-20020187961-A1 Omega-cycloalkyl 17-heteroaryl prostaglandin E2 analogs as EP2-receptor agonists ALLERGAN, INC. 2002-12-12 US claimed
US-6586462-B2 ω-Cycloalkyl 17-heteroaryl prostaglandin E2 analogs as EP2-receptor agonists ALLERGAN, INC. 2003-07-01 US disclosed
US-20020187961-A1 Omega-cycloalkyl 17-heteroaryl prostaglandin E2 analogs as EP2-receptor agonists ALLERGAN, INC. 2002-12-12 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 (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-20020187961-A1 Omega-cycloalkyl 17-heteroaryl prostaglandin E2 analogs as EP2-receptor agonists PTGER2, PTGER1, PTGER3 PTGIR 5/4885PTGER2 1/4885PTGER3 3/4885

“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.