SCHEMBL17845073

SCHEMBL17845073

CCCCNC(C)=CC(=O)OCCC

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.50
ATM Q13315 1/20 0.44
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
HCAR2 Q8TDS4 1/20 0.42
EPHX1 P07099 2/20 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
SCHEMBL19602219 1.00 ACHE (0.50) ACHEATMHPGDTSHRHCAR2
SCHEMBL11048980 0.93 ACHE (0.56) ACHEATMHPGDTSHRHCAR2
Ethylene Glycol SCHEMBL11048976 0.89 ACHE (0.54) ACHEATMHPGDTSHRHCAR2
SCHEMBL10653785 0.88 ACHE (0.47) ACHEEPHX1
SCHEMBL10665052 0.88 ACHE (0.47) ACHEEPHX1
SCHEMBL11996069 0.86 ACHE (0.47) ACHEATMHPGDTSHR
SCHEMBL10989604 0.85 ZDHHC20 (0.43) ACHEATMHPGDTSHR
SCHEMBL1143798 0.84 ACHE (0.46) ACHEEPHX1
SCHEMBL10558937 0.84 HCAR2 (0.46) ACHEATMHPGDTSHRHCAR2
SCHEMBL10558948 0.84 HCAR2 (0.46) ACHEATMHPGDTSHRHCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233978-B1 COMPOSITIONS COMPRISING A POLYMERIC NETWORK UNIV GENT (BE) 2021-03-03 EP disclosed
US-10246548-B2 Compositions comprising a polymeric network UNIVERSITEIT GENT (BE) 2019-04-02 US disclosed
US-20170327625-A1 COMPOSITIONS COMPRISING A POLYMERIC NETWORK ECOLE SUPÉRIEURE DE PHYSIQUE ET DE CHIMIE INDUSTRIELLES DE LA VILLE DE PARIS (FR) 2017-11-16 US disclosed
EP-3233978-A1 COMPOSITIONS COMPRISING A POLYMERIC NETWORK Universiteit Gent (BE) 2017-10-25 EP disclosed
WO-2016097169-A1 COMPOSITIONS COMPRISING A POLYMERIC NETWORK UNIVERSITEIT GENT (BE) 2016-06-23 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-20170327625-A1 COMPOSITIONS COMPRISING A POLYMERIC NETWORK CHRNA5, CHRNA1, CHRM1 ACHE 2487/4885ATM 3559/4885HPGD 3266/4885
US-10246548-B2 Compositions comprising a polymeric network CHRNA5, CHRNA1, CHRM1 ACHE 2802/4885ATM 3795/4885HPGD 3481/4885

“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.