SCHEMBL3658864

SCHEMBL3658864

O=C(O)CN1CCC(C2c3ccccc3Oc3ccccc32)CC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 3/20 0.44
CHRM1 P11229 3/20 0.44
CHRM3 P20309 3/20 0.44
CCR1 P32246 4/20 0.43
TSHR P16473 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
CYP2C9 P11712 1/20 0.40
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL3660309 0.84 CACNA1G (0.45) TSHRNPSR1CYP2C9HTTRECQL
SCHEMBL5103233 0.76 SIGMAR1 (0.46) CHRM2CHRM1CHRM3CCR1
SCHEMBL7535279 0.75 MAOA (0.52) CHRM2CHRM1CHRM3TSHRLMNA
SCHEMBL14307948 0.74 KDM1A (0.41) CYP2C9
SCHEMBL3873258 0.71 TERT (0.47)
SCHEMBL8816954 0.70 MAOA (0.47) CHRM2CHRM1CHRM3CCR1LMNA
SCHEMBL7202138 0.69 SLC18A3 (0.62) TSHRLMNATP53
SCHEMBL26986921 0.69 HSD17B10 (0.50) NPSR1HTTRECQL
SCHEMBL23816922 0.68 SLC18A3 (0.60) LMNA
SCHEMBL3660571 0.68 DRD2 (0.62)

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 4 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
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 CHRM2 891/4885CHRM1 560/4885CHRM3 913/4885

“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.