SCHEMBL14784352

SCHEMBL14784352

O=Cc1cc(Cl)ccc1OC1CCC1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
POLB P06746 1/20 0.43
CSNK2A1 P68400 2/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SLC6A4 P31645 1/20 0.39
HTR6 P50406 1/20 0.39
HPGD P15428 1/20 0.39
PDE4B Q07343 1/20 0.38
KMO O15229 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38

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
SCHEMBL7662729 0.98 POLB (0.45) ERN1TDP1POLBCSNK2A1MEN1
SCHEMBL275626 0.97 POLB (0.44) ERN1TDP1POLBCSNK2A1MEN1
SCHEMBL275979 0.88 CHEK1 (0.42) ERN1TDP1MEN1KMT2APDE4B
SCHEMBL274642 0.88 ERN1 (0.40) ERN1TDP1MEN1KMT2AHPGD
SCHEMBL3663943 0.84 TDP1 (0.44) ERN1TDP1POLBCSNK2A1SLC6A4
SCHEMBL275938 0.82 CACNB4 (0.41) ERN1TDP1POLBMEN1KMT2A
SCHEMBL24190659 0.81 TDP1 (0.48) ERN1TDP1POLBSLC6A4HTR6
SCHEMBL30396359 0.81 TDP1 (0.48) ERN1TDP1POLBSLC6A4HTR6
SCHEMBL18003630 0.80 POLB (0.49) ERN1TDP1POLBSLC6A4HTR6
SCHEMBL275350 0.80 FPR2 (0.36) ERN1POLBMEN1KMT2AHPGD

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-2766344-B1 EP1 RECEPTOR LIGANDS ESTEVE LABOR DR (ES) 2017-05-03 EP disclosed
US-9518015-B2 EP1 receptor ligands LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2016-12-13 US disclosed
US-20140323475-A1 EP1 RECEPTOR LIGANDS ESTEVE PHARMACEUTICALS, S.A. (ES) 2014-10-30 US disclosed
EP-2766344-A1 EP1 RECEPTOR LIGANDS Laboratorios Del. Dr. Esteve, S.A. (ES) 2014-08-20 EP disclosed
WO-2013037960-A1 EP1 RECEPTOR LIGANDS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2013-03-21 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 (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-20140323475-A1 EP1 RECEPTOR LIGANDS PTGER1, PTGER2, PTGIR ERN1 1084/4885TDP1 4377/4885POLB 4415/4885

“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.