SCHEMBL3079526

SCHEMBL3079526

Cc1ccc(NC(=O)N[C@H]2CC[C@H](CCN3CCC(Oc4ccc(F)cc4)CC3)CC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 16/20 0.60
FAAH O00519 4/20 0.58
RECQL P46063 1/20 0.55
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HTR1A P08908 1/20 0.50
HTR7 P34969 1/20 0.50

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
SCHEMBL3079529 1.00 EPHX2 (0.60) EPHX2FAAHRECQLMEN1KMT2A
SCHEMBL3069359 0.91 EPHX2 (0.74) EPHX2FAAHRECQL
SCHEMBL3069356 0.91 EPHX2 (0.74) EPHX2FAAHRECQL
SCHEMBL27900170 0.86 EPHX2 (0.51) EPHX2FAAH
SCHEMBL3090192 0.86 RECQL (0.48) EPHX2RECQLMEN1KMT2ASMN1; SMN2
SCHEMBL3090193 0.86 RECQL (0.48) EPHX2RECQLMEN1KMT2ASMN1; SMN2
SCHEMBL3179645 0.86 EPHX2 (0.78) EPHX2FAAH
SCHEMBL3179642 0.86 EPHX2 (0.78) EPHX2FAAH
SCHEMBL3088045 0.85 DRD3 (0.55) EPHX2
SCHEMBL3079841 0.85 DRD3 (0.55) EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2079693-B1 ETHER DERIVATIVES DUAL MODULATORS OF THE 5-HT2A AND D3 RECEPTORS HOFFMANN LA ROCHE (CH) 2013-02-27 EP claimed
US-7795437-B2 Ether derivatives HOFFMANN-LA ROCHE INC. (US) 2010-09-14 US claimed
US-20080103174-A1 ETHER DERIVATIVES HOFFMANN-LA ROCHE INC. 2008-05-01 US claimed
EP-2079693-B1 ETHER DERIVATIVES DUAL MODULATORS OF THE 5-HT2A AND D3 RECEPTORS HOFFMANN LA ROCHE (CH) 2013-02-27 EP disclosed
US-7795437-B2 Ether derivatives HOFFMANN-LA ROCHE INC. (US) 2010-09-14 US disclosed
US-20080103174-A1 ETHER DERIVATIVES HOFFMANN-LA ROCHE INC. 2008-05-01 US 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-20080103174-A1 ETHER DERIVATIVES GABRE, BDNF, ADH1A EPHX2 602/4885FAAH 1229/4885RECQL 4130/4885

“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.