SCHEMBL4157535

SCHEMBL4157535

CC1CN(C(c2ccccc2)c2ccccc2)C(C)CN1CC(=O)O

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 11/20 0.67
OPRD1 P41143 2/20 0.63
KDM4E B2RXH2 2/20 0.55
CYP1A2 P05177 2/20 0.55
CYP3A4 P08684 2/20 0.55
CYP2C9 P11712 2/20 0.55
HPGD P15428 2/20 0.55
CYP2C19 P33261 2/20 0.55

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
SCHEMBL7602157 1.00 SLC6A9 (0.67) SLC6A9OPRD1KDM4ECYP1A2CYP3A4
Hydrochloric Acid SCHEMBL4136253 0.99 SLC6A9 (0.65) SLC6A9OPRD1KDM4ECYP1A2CYP3A4
Hydrochloric Acid SCHEMBL4148441 0.99 SLC6A9 (0.65) SLC6A9OPRD1KDM4ECYP1A2CYP3A4
Hydrochloric Acid SCHEMBL4158726 0.99 SLC6A9 (0.65) SLC6A9OPRD1KDM4ECYP1A2CYP3A4
SCHEMBL6937064 0.90 CYP1A2 (0.57) OPRD1CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL6937062 0.90 CYP1A2 (0.57) OPRD1CYP1A2CYP3A4CYP2C9HPGD
SCHEMBL4439268 0.85 SLC6A9 (0.60) SLC6A9OPRD1KDM4ECYP1A2CYP3A4
SCHEMBL7665838 0.82 OPRD1 (0.69) SLC6A9OPRD1KDM4ECYP1A2CYP3A4
SCHEMBL6935489 0.81 OPRD1 (0.51) SLC6A9OPRD1CYP1A2CYP3A4
SCHEMBL4148214 0.81 CYP1A2 (0.53) OPRD1CYP1A2CYP3A4CYP2C9HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8735383-B2 Glycine transporter-1 inhibitors AMGEN INC. (US) 2014-05-27 US claimed
EP-2041088-B1 GLYCINE TRANSPORTER-1 INHIBITORS AMGEN INC (US) 2014-01-08 EP claimed
US-20120195985-A1 GLYCINE TRANSPORTER-1 INHIBITORS AMGEN INC. (US) 2012-08-02 US claimed
US-20090227595-A1 GLYCINE TRANSPORTER-1 INHIBITORS HITCHCOCK STEPHEN 2009-09-10 US claimed
US-7538114-B2 Glycine transporter-1 inhibitors AMGEN INC. (US) 2009-05-26 US claimed
US-20080004289-A1 Glycine transporter-1 inhibitors AMGEN INC. 2008-01-03 US claimed
EP-2947067-A1 Glycine transporter-1 inhibitors Amgen, Inc (US) 2015-11-25 EP disclosed
EP-2565183-A1 Glycine transporter-1 inhibitors Amgen Inc. (US) 2013-03-06 EP 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 (3 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-20090227595-A1 GLYCINE TRANSPORTER-1 INHIBITORS SLC18A2, SLC7A11, SLC6A5 SLC6A9 8/4885OPRD1 2137/4885KDM4E 3389/4885
US-20120195985-A1 GLYCINE TRANSPORTER-1 INHIBITORS SLC18A2, SLC6A5, SLC1A2 SLC6A9 6/4885OPRD1 2031/4885KDM4E 3474/4885
US-20080004289-A1 Glycine transporter-1 inhibitors SLC18A2, SLC7A11, SLC6A5 SLC6A9 8/4885OPRD1 2137/4885KDM4E 3389/4885

“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.