SCHEMBL6502054

SCHEMBL6502054

CCN(CCOC)c1ccc(NCC2C3CN(C(=O)c4ccc(C(C)(C)C)cc4)CC23)cn1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.42
TRPV1 Q8NER1 4/20 0.38
ADRA1A P35348 1/20 0.37
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
TSHR P16473 2/20 0.35
NPY5R Q15761 2/20 0.35
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CNR2 P34972 1/20 0.33

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
SCHEMBL4550710 0.91 ADRA1A (0.46) DGAT1TRPV1ADRA1ACRHBPCRHR2
SCHEMBL4415368 0.79 CRHBP (0.42) CRHBPCRHR2MEN1KMT2ANPY5R
SCHEMBL4418680 0.78 TRPV1 (0.39) TRPV1CRHBPCRHR2NPY5RSMN1; SMN2
SCHEMBL4552442 0.78 MEN1 (0.34) CRHBPCRHR2MEN1KMT2ATSHR
SCHEMBL2179917 0.77 LMNA (0.35) DGAT1ADRA1AMEN1KMT2ALMNA
SCHEMBL18887325 0.76 LMNA (0.33) DGAT1ADRA1AMEN1KMT2ALMNA
SCHEMBL4415691 0.76 TRPV1 (0.52) TRPV1CRHBPCRHR2MEN1KMT2A
SCHEMBL4418781 0.75 TSHR (0.44) CRHBPCRHR2MEN1KMT2ATSHR
SCHEMBL4415708 0.75 SMN1; SMN2 (0.51) TRPV1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL4414893 0.75 HIF1A (0.50) CRHBPCRHR2MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1680124-B1 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS PFIZER PROD INC (US) 2017-05-31 EP claimed
US-20050096375-A1 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors PFIZER INC. 2005-05-05 US claimed
EP-1680124-B1 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS PFIZER PROD INC (US) 2017-05-31 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 (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-20050096375-A1 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors SLC6A5, SLC1A5, SLC6A3 DGAT1 720/4885TRPV1 1359/4885ADRA1A 618/4885

“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.