SCHEMBL3663419

SCHEMBL3663419

O=C(O)CN1CCC(N(c2ccccc2)c2cccc(-c3ccsc3)c2)C1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.47
DRD4 P21917 5/20 0.47
OPRD1 P41143 13/20 0.42
OPRM1 P35372 12/20 0.42
OPRK1 P41145 12/20 0.42
CCR5 P51681 1/20 0.40
DRD3 P35462 1/20 0.39

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
SCHEMBL3659645 0.82 OPRM1 (0.46) DRD2DRD4OPRD1OPRM1OPRK1
SCHEMBL3664394 0.82 GRIN2B (0.45) OPRD1OPRM1OPRK1CCR5
SCHEMBL3665788 0.80 OPRD1 (0.42) OPRD1OPRM1OPRK1
SCHEMBL3661001 0.79 OPRD1 (0.42) OPRD1OPRM1OPRK1
SCHEMBL3659597 0.74 CYP3A4 (0.48) DRD2DRD4OPRD1OPRM1CCR5
SCHEMBL3661017 0.74 OPRD1 (0.51) OPRD1OPRM1OPRK1CCR5
SCHEMBL3662630 0.72 UTS2R (0.48) OPRM1
SCHEMBL3659668 0.71 KMT2A (0.51) OPRD1OPRM1OPRK1
SCHEMBL3664734 0.69 CYP3A4 (0.41) OPRD1OPRM1
SCHEMBL3660528 0.68 KDM2B (0.44) CCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2231601-B1 GLYCINE TRANSPORTER-1 INHIBITORS AMGEN INC (US) 2014-06-18 EP claimed
US-20100298341-A1 Glycine Transporter-1 Inhibitors AMGEN INC. 2010-11-25 US claimed
EP-2231601-A2 GLYCINE TRANSPORTER-1 INHIBITORS Amgen, Inc (US) 2010-09-29 EP claimed
WO-2009075857-A2 GLYCINE TRANSPORTER-1 INHIBITORS AMGEN INC. (US) 2009-06-18 WO claimed
EP-2231601-B1 GLYCINE TRANSPORTER-1 INHIBITORS AMGEN INC (US) 2014-06-18 EP disclosed
US-8258306-B2 Glycine transporter-1 inhibitors AMGEN INC. (US) 2012-09-04 US disclosed
US-20100298341-A1 Glycine Transporter-1 Inhibitors AMGEN INC. 2010-11-25 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-20100298341-A1 Glycine Transporter-1 Inhibitors SLC18A2, SLC7A11, SLC6A5 DRD2 754/4885DRD4 921/4885OPRD1 2137/4885

“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.