SCHEMBL4426434

SCHEMBL4426434

CC(C)(C)c1ccc(C(=O)N2CC3C(CNc4ccc(N5CCC(N6CCCC6)C5)nc4)C3C2)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.45
ADRA1A P35348 5/20 0.43
HDAC1 Q13547 1/20 0.40
L3MBTL3 Q96JM7 4/20 0.39
L3MBTL1 Q9Y468 4/20 0.39
MBTD1 Q05BQ5 2/20 0.38
TP53BP1 Q12888 2/20 0.38
L3MBTL4 Q8NA19 2/20 0.38
IKBKB O14920 2/20 0.38
CHUK O15111 2/20 0.38
IKBKG Q9Y6K9 2/20 0.38
KCNH2 Q12809 1/20 0.38
MCHR1 Q99705 1/20 0.38
HRH3 Q9Y5N1 2/20 0.37

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
SCHEMBL4414899 0.93 TRPV1 (0.43) TRPV1ADRA1AL3MBTL3L3MBTL1
SCHEMBL4415691 0.89 TRPV1 (0.52) TRPV1MCHR1
SCHEMBL4423657 0.87 MAPT (0.42) TRPV1ADRA1A
SCHEMBL4425779 0.87 TRPV1 (0.48) TRPV1ADRA1AHDAC1L3MBTL3L3MBTL1
SCHEMBL4419310 0.86 TRPV1 (0.42) TRPV1
SCHEMBL4418100 0.86 MCHR1 (0.46) TRPV1L3MBTL3KCNH2MCHR1HRH3
SCHEMBL4425066 0.85 TRPV1 (0.45) TRPV1L3MBTL1KCNH2MCHR1
SCHEMBL4415708 0.85 SMN1; SMN2 (0.51) TRPV1L3MBTL1
SCHEMBL4414870 0.84 TRPV1 (0.44) TRPV1
SCHEMBL4417791 0.84 MAPT (0.46) TRPV1

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-1680124-B1 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS PFIZER PROD INC (US) 2017-05-31 EP claimed
EP-1680124-A4 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS PFIZER PROD INC (US) 2009-05-13 EP claimed
JP-2007508374-A 2007-04-05 JP claimed
EP-1680124-A2 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS Pfizer Products Incorporated (US) 2006-07-19 EP claimed
US-20050096375-A1 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors PFIZER INC. 2005-05-05 US claimed
WO-2005037216-A2 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS PFIZER PRODUCTS INC. (US) 2005-04-28 WO 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 TRPV1 1359/4885ADRA1A 618/4885HDAC1 3929/4885

“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.