SCHEMBL3661001

SCHEMBL3661001

O=C(O)CN1CCC(N(c2ccccc2)c2cccc(Br)c2)C1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 14/20 0.42
OPRM1 P35372 10/20 0.42
OPRK1 P41145 10/20 0.42
CHRM2 P08172 2/20 0.42
CHRM3 P20309 2/20 0.42
HTR7 P34969 1/20 0.42
SLC6A9 P48067 2/20 0.41
SIGMAR1 Q99720 1/20 0.41

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 0.89 OPRM1 (0.46) OPRD1OPRM1OPRK1CHRM2CHRM3
SCHEMBL3659597 0.81 CYP3A4 (0.48) OPRD1OPRM1SIGMAR1
SCHEMBL3661017 0.80 OPRD1 (0.51) OPRD1OPRM1OPRK1CHRM2CHRM3
SCHEMBL3662547 0.80 HRH3 (0.47) OPRM1CHRM2CHRM3
SCHEMBL3665788 0.79 OPRD1 (0.42) OPRD1OPRM1OPRK1
SCHEMBL3663419 0.79 DRD2 (0.47) OPRD1OPRM1OPRK1
SCHEMBL3664394 0.79 GRIN2B (0.45) OPRD1OPRM1OPRK1CHRM3
SCHEMBL3662630 0.78 UTS2R (0.48) OPRM1SLC6A9SIGMAR1
SCHEMBL3659668 0.77 KMT2A (0.51) OPRD1OPRM1OPRK1HTR7SIGMAR1
SCHEMBL3660528 0.74 KDM2B (0.44) SIGMAR1

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-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
EP-2231601-A2 GLYCINE TRANSPORTER-1 INHIBITORS Amgen, Inc (US) 2010-09-29 EP disclosed
WO-2009075857-A2 GLYCINE TRANSPORTER-1 INHIBITORS AMGEN INC. (US) 2009-06-18 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-20100298341-A1 Glycine Transporter-1 Inhibitors SLC18A2, SLC7A11, SLC6A5 OPRD1 2137/4885OPRM1 1216/4885OPRK1 1378/4885

“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.