SCHEMBL3702586

SCHEMBL3702586

CC/C=C\CCCCC#CCCCCC#CCCCC(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.64
F7 P08709 5/20 0.64
F3 P13726 5/20 0.64
MAPT P10636 5/20 0.64
CYP19A1 P11511 4/20 0.64
KMT2A Q03164 4/20 0.64
PPARG P37231 4/20 0.64
PPARD Q03181 4/20 0.64
PPARA Q07869 4/20 0.64
BLM P54132 4/20 0.64
PTGS1 P23219 3/20 0.64
RECQL P46063 3/20 0.64
HSD17B10 Q99714 3/20 0.64
OXER1 Q8TDS5 2/20 0.64
KDM4E B2RXH2 2/20 0.64
MEN1 O00255 2/20 0.64
HPGD P15428 2/20 0.64
TDP1 Q9NUW8 2/20 0.64
LMNA P02545 2/20 0.64
ALOX15 P16050 2/20 0.64

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
SCHEMBL10812210 0.85 PTPN7 (0.81) ALDH1A1F7F3MAPTCYP19A1
SCHEMBL10812206 0.85 PTPN7 (0.81) ALDH1A1F7F3MAPTCYP19A1
SCHEMBL1041523 0.85 F7 (0.85) ALDH1A1F7F3MAPTCYP19A1
SCHEMBL1041522 0.85 F7 (0.85) ALDH1A1F7F3MAPTCYP19A1
SCHEMBL23698075 0.85 PPARG (0.84) ALDH1A1F7F3MAPTCYP19A1
SCHEMBL23698073 0.85 PPARG (0.84) ALDH1A1F7F3MAPTCYP19A1
SCHEMBL7750548 0.85 F7 (0.85) ALDH1A1F7F3MAPTCYP19A1
SCHEMBL25326380 0.83 ALDH1A1 (0.89) ALDH1A1F7F3MAPTCYP19A1
SCHEMBL23698131 0.83 F7 (0.81) ALDH1A1F7F3MAPTCYP19A1
SCHEMBL23698190 0.83 F7 (0.81) ALDH1A1F7F3MAPTCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11365183-B2 Eicosanoid derivatives MAX-DELBRUECK-CENTRUM FUER MOLEKULARE MEDIZIN (DE) 2022-06-21 US disclosed
US-20190315701-A1 NOVEL EICOSANOID DERIVATIVES MAX-DELBRUECK-CENTRUM FUER MOLEKULARE MEDIZIN (DE) 2019-10-17 US disclosed
US-10287262-B2 Eicosanoid derivatives MAX-DELBRUECK-CENTRUM FUER MOLEKULARE MEDIZIN (DE) 2019-05-14 US disclosed
EP-3222612-A1 NOVEL EICOSANOID DERIVATIVES Max-Delbrück-Centrum für Molekulare Medizin (MDC) (DE) 2017-09-27 EP disclosed
EP-2376432-B1 NOVEL EICOSANOID DERIVATIVES MAX-DELBRÜCK-CENTRUM FÜR MOLEKULARE MEDIZIN (MDC) (DE) 2017-04-12 EP disclosed
EP-2376432-B1 NOVEL EICOSANOID DERIVATIVES MAX-DELBRÜCK-CENTRUM FÜR MOLEKULARE MEDIZIN (MDC) (DE) 2017-04-12 EP disclosed
US-20160326128-A1 NOVEL EICOSANOID DERIVATIVES MAX-DELBRUECK-CENTRUM FUER MOLEKULARE MEDIZIN (DE) 2016-11-10 US disclosed
US-20160326128-A1 NOVEL EICOSANOID DERIVATIVES MAX-DELBRUECK-CENTRUM FUER MOLEKULARE MEDIZIN (DE) 2016-11-10 US disclosed
US-20160326128-A1 NOVEL EICOSANOID DERIVATIVES MAX-DELBRUECK-CENTRUM FUER MOLEKULARE MEDIZIN (DE) 2016-11-10 US disclosed
US-9272991-B2 Eicosanoid derivatives MAX-DELBRUECK-CENTRUM FUER MOLEKULARE MEDIZIN (MDC) (DE) 2016-03-01 US disclosed
US-9272991-B2 Eicosanoid derivatives MAX-DELBRUECK-CENTRUM FUER MOLEKULARE MEDIZIN (MDC) (DE) 2016-03-01 US disclosed
US-9272991-B2 Eicosanoid derivatives MAX-DELBRUECK-CENTRUM FUER MOLEKULARE MEDIZIN (MDC) (DE) 2016-03-01 US disclosed
US-20120122972-A1 NOVEL EICOSANOID DERIVATIVES MAX-DELBRUECK-CENTRUM FUER MOLEKULARE MEDIZIN (MDC) (DE) 2012-05-17 US disclosed
US-20120122972-A1 NOVEL EICOSANOID DERIVATIVES MAX-DELBRUECK-CENTRUM FUER MOLEKULARE MEDIZIN (MDC) (DE) 2012-05-17 US disclosed
US-20120122972-A1 NOVEL EICOSANOID DERIVATIVES MAX-DELBRUECK-CENTRUM FUER MOLEKULARE MEDIZIN (MDC) (DE) 2012-05-17 US disclosed
WO-2010081683-A1 NOVEL EICOSANOID DERIVATIVES Max-Delbrück-Centrum für Molekulare Medizin (DE) 2010-07-22 WO disclosed
EP-2208720-A1 Novel eicosanoid derivatives Max-Delbrück-Centrum für Molekulare Medizin (MDC) (DE) 2010-07-21 EP disclosed
EP-2208720-A1 Novel eicosanoid derivatives Max-Delbrück-Centrum für Molekulare Medizin (MDC) (DE) 2010-07-21 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 (5 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-20120122972-A1 NOVEL EICOSANOID DERIVATIVES FABP3, PTGER3, PTGES3 ALDH1A1 646/4885F7 3837/4885F3 1528/4885
US-10287262-B2 Eicosanoid derivatives FABP3, PTGER3, PTGES3 ALDH1A1 708/4885F7 3569/4885F3 1287/4885
US-11365183-B2 Eicosanoid derivatives FABP3, PTGER3, PTGES3 ALDH1A1 708/4885F7 3569/4885F3 1287/4885
US-20160326128-A1 NOVEL EICOSANOID DERIVATIVES FABP3, PTGER3, PTGES3 ALDH1A1 710/4885F7 4088/4885F3 1669/4885
US-20190315701-A1 NOVEL EICOSANOID DERIVATIVES FABP3, PTGER3, PTGES3 ALDH1A1 710/4885F7 4088/4885F3 1669/4885

“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.