SCHEMBL6797382

SCHEMBL6797382

CCCCc1ccc(C(C(C)=O)C(=O)OC)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
PLK1 P53350 1/20 0.46
ALDH1A1 P00352 4/20 0.46
HPGD P15428 3/20 0.46
HSD17B10 Q99714 1/20 0.46
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
RARB P10826 1/20 0.43
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
TRPV1 Q8NER1 1/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 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
SCHEMBL6839674 0.88 ALDH1A1 (0.51) ALDH1A1HSD17B10RARBTHRATHRB
SCHEMBL7904948 0.84 ALDH1A1 (0.51) ALDH1A1NPC1RAB9ASMN1; SMN2ESR1
SCHEMBL6839675 0.83 ALDH1A1 (0.50) POLBPLK1ALDH1A1HPGDHSD17B10
SCHEMBL27994082 0.80 CYSLTR2 (0.46) ALDH1A1HSD17B10RARBTHRATHRB
SCHEMBL10651772 0.77 ESR1 (0.47) POLBPLK1ALDH1A1HPGDHSD17B10
SCHEMBL9008882 0.77 SPHK1 (0.48) POLBPLK1ALDH1A1HPGDHSD17B10
SCHEMBL6839732 0.77 CYSLTR2 (0.51) ALDH1A1HSD17B10RARBTHRATHRB
Hydrochloric Acid SCHEMBL9008881 0.76 ALDH1A1 (0.49) POLBPLK1ALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL9008878 0.76 ALDH1A1 (0.49) POLBPLK1ALDH1A1HPGDHSD17B10
SCHEMBL28943034 0.75 SPHK1 (0.48) ALDH1A1HSD17B10THRATHRBESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040063959-A1 Esters and amides as PLA2 inhibitors FUKAMI NAOKI (JP) 2004-04-01 US disclosed
US-20020169326-A1 Esters and amides as PLA2 inhibitors FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 2002-11-14 US disclosed
EP-0854863-B1 ESTERS AND AMIDES AS PLA2 INHIBITORS FUJISAWA PHARMACEUTICAL CO (JP) 2002-10-30 EP disclosed
US-20020019416-A1 ESTERS AND AMIDES AS PLA2 INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-02-14 US disclosed
CN-1056602-C Esters and amides as PLA2 inhibitors FUJISAWA PHARMACEUTICAL CO (JP) 2000-09-20 CN disclosed
CN-1197450-A Esters and amides as phospholipase A2 inhibitors FUJISAWA PHARMACEUTICAL CO (JP) 1998-10-28 CN disclosed
EP-0854863-A1 ESTERS AND AMIDES AS PLA2 INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-07-29 EP disclosed
WO-1997003951-A1 ESTERS AND AMIDES AS PLA2 INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-02-06 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 (3 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-20040063959-A1 Esters and amides as PLA2 inhibitors PLA2G4A, PLA2G2D, PLA2G4B POLB 3266/4885PLK1 2283/4885ALDH1A1 800/4885
US-20020019416-A1 ESTERS AND AMIDES AS PLA2 INHIBITORS PLA2G4A, PLA2G4B, PLA2G1B POLB 3237/4885PLK1 2273/4885ALDH1A1 700/4885
US-20020169326-A1 Esters and amides as PLA2 inhibitors PLA2G4A, PLA2G2D, PLA2G4B POLB 3189/4885PLK1 2348/4885ALDH1A1 737/4885

“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.