SCHEMBL14920566

SCHEMBL14920566

OCCOCCn1ccnc1-c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.58
PDE6D O43924 4/20 0.46
ALDH1A1 P00352 4/20 0.43
POLB P06746 1/20 0.43
HTT P42858 1/20 0.43
PLAA Q9Y263 1/20 0.43
ALPG P10696 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
HIF1A Q16665 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA3 P07451 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40

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
SCHEMBL14921162 0.88 ESR1 (0.47) ESR1PDE6DALDH1A1POLBHTT
SCHEMBL5662079 0.84 ESR1 (0.69) ESR1PDE6DPLAAALPGCYP3A4
SCHEMBL16212158 0.84 ESR1 (0.56) ESR1PDE6DALDH1A1POLBHTT
SCHEMBL13587978 0.84 ESR1 (0.56) ESR1PDE6DALDH1A1POLBHTT
SCHEMBL5707890 0.80 ESR1 (0.67) ESR1PDE6DALDH1A1PLAAALPG
SCHEMBL7095574 0.77 ESR1 (0.68) ESR1PDE6DALDH1A1POLBPLAA
SCHEMBL27452733 0.77 ESR1 (0.63) ESR1PDE6DPLAAALPGCYP3A4
SCHEMBL13587983 0.77 ESR1 (0.63) ESR1PDE6DPLAAALPGCYP3A4
SCHEMBL5657679 0.75 ESR1 (0.61) ESR1PDE6DPLAAALPGCYP3A4
SCHEMBL9444420 0.74 ESR1 (0.64) ESR1PDE6DALDH1A1POLBPLAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2773378-B1 PRODRUGS OF NON-STEROID ANTI-INFLAMMATORY AGENTS (NSAIDS) SELCH LARSEN CLAUS (DK) 2016-08-10 EP claimed
US-9937262-B2 Prodrugs of naproxen and diclofenac LARSEN, CLAUS SELCH (DK) 2018-04-10 US disclosed
US-9809557-B2 Prodrugs of non-steroid anti-inflammatory agents (NSAIDS) SELCH LARSEN CLAUS (DK) 2017-11-07 US disclosed
US-9809557-B2 Prodrugs of non-steroid anti-inflammatory agents (NSAIDS) SELCH LARSEN CLAUS (DK) 2017-11-07 US disclosed
US-9809557-B2 Prodrugs of non-steroid anti-inflammatory agents (NSAIDS) SELCH LARSEN CLAUS (DK) 2017-11-07 US disclosed
EP-2991682-B1 PRODRUGS OF NAPROXEN AND DICLOFENAC SELCH LARSEN CLAUS (DK) 2017-04-19 EP disclosed
EP-2773378-B1 PRODRUGS OF NON-STEROID ANTI-INFLAMMATORY AGENTS (NSAIDS) SELCH LARSEN CLAUS (DK) 2016-08-10 EP disclosed
US-20160074523-A1 PRODRUGS OF NAPROXEN AND DICLOFENAC LARSEN, CLAUS SELCH (DK) 2016-03-17 US disclosed
EP-2991682-A1 PRODRUGS OF NAPROXEN AND DICLOFENAC Larsen, Claus Selch (DK) 2016-03-09 EP disclosed
WO-2014177479-A1 PRODRUGS OF NAPROXEN AND DICLOFENAC SELCH LARSEN CLAUS (DK) 2014-11-06 WO disclosed
US-20140315960-A1 PRODRUGS OF NON-STEROID ANTI-INFLAMMATORY AGENTS (NSAIDS) SELCH LARSEN CLAUS (DK) 2014-10-23 US disclosed
US-20140315960-A1 PRODRUGS OF NON-STEROID ANTI-INFLAMMATORY AGENTS (NSAIDS) SELCH LARSEN CLAUS (DK) 2014-10-23 US disclosed
US-20140315960-A1 PRODRUGS OF NON-STEROID ANTI-INFLAMMATORY AGENTS (NSAIDS) SELCH LARSEN CLAUS (DK) 2014-10-23 US disclosed
EP-2773378-A1 PRODRUGS OF NON- STEROID ANTI - INFLAMMATORY AGENTS (NSAIDS) Larsen, Claus Selch (DK) 2014-09-10 EP disclosed
WO-2013064153-A1 PRODRUGS OF NON- STEROID ANTI - INFLAMMATORY AGENTS (NSAIDS) SELCH LARSEN CLAUS (DK) 2013-05-10 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 (2 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-20140315960-A1 PRODRUGS OF NON-STEROID ANTI-INFLAMMATORY AGENTS (NSAIDS) MMP1, MIF, CYP21A2 ESR1 1365/4885PDE6D 1521/4885ALDH1A1 406/4885
US-20160074523-A1 PRODRUGS OF NAPROXEN AND DICLOFENAC CYP2D6, CYP2U1, PTGER1 ESR1 2088/4885PDE6D 545/4885ALDH1A1 201/4885

“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.