SCHEMBL3992489

SCHEMBL3992489

CCCCC(OC1CCCCO1)C(F)(F)C=C[C@@H]1[C@@H](CC=CCCCC(=O)O)[C@@H](O)C[C@H]1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGFR P43088 13/20 0.55
▸ TBXA2R P21731 5/20 0.55
▸ PTGER3 P43115 5/20 0.55
▸ LMNA P02545 3/20 0.55
▸ ALDH1A1 P00352 3/20 0.55
▸ PTGER1 P34995 3/20 0.55
▸ PTGER4 P35408 1/20 0.55
▸ PTGDR Q13258 1/20 0.55
▸ SLCO2A1 Q92959 1/20 0.55
▸ HPGD P15428 2/20 0.53
▸ TSHR P16473 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ HIF1A Q16665 1/20 0.53
▸ ABCC4 O15439 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.47
▸ HKDC1 Q2TB90 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ SAE1 Q9UBE0 1/20 0.47
▸ UBA2 Q9UBT2 1/20 0.47
▸ MEN1 O00255 1/20 0.43

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
SCHEMBL3992485 1.00 PTGFR (0.55) PTGFRTBXA2RPTGER3LMNAALDH1A1
SCHEMBL4111896 0.85 PTGER4 (0.57) PTGFRTBXA2RPTGER3LMNAALDH1A1
SCHEMBL4112689 0.85 ALDH1A1 (0.57) PTGFRTBXA2RPTGER3LMNAALDH1A1
SCHEMBL4111899 0.85 PTGER4 (0.57) PTGFRTBXA2RPTGER3LMNAALDH1A1
SCHEMBL4112690 0.85 ALDH1A1 (0.57) PTGFRTBXA2RPTGER3LMNAALDH1A1
SCHEMBL4192876 0.85 ALDH1A1 (0.46) PTGFRTBXA2RPTGER3LMNAALDH1A1
SCHEMBL4192872 0.85 ALDH1A1 (0.46) PTGFRTBXA2RPTGER3LMNAALDH1A1
SCHEMBL11095586 0.83 PTGFR (0.67) PTGFRTBXA2RPTGER3LMNAALDH1A1
SCHEMBL4100854 0.79 MAPT (0.41) PTGFRTBXA2RPTGER3LMNAALDH1A1
SCHEMBL4100856 0.79 MAPT (0.41) PTGFRTBXA2RPTGER3LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009065081-A2 PROSTAGLANDIN E1 AND E2 ANALOGS FOR THE TREATMENT OF VARIOUS MEDICAL CONDITIONS CAYMAN CHEMICAL COMPANY (US) 2009-05-22 — — WO disclosed
US-20090124695-A1 PROSTAGLANDIN E1 AND E2 ANALOGS FOR THE TREATMENT OF VARIOUS MEDICAL CONDITIONS CAYMAN CHEMICAL COMPANY (US) 2009-05-14 — — 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-20090124695-A1 PROSTAGLANDIN E1 AND E2 ANALOGS FOR THE TREATMENT OF VARIOUS MEDICAL CONDITIONS PTGER1, PTGER4, PTGER2 PTGFR 10/4885TBXA2R 18/4885PTGER3 5/4885

“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.

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