SCHEMBL4422647

SCHEMBL4422647

CCC(C)(C)c1ccc(S(=O)(=O)N2CC3C(CNc4ccc(N5CCOCC5)c(F)c4)C3C2)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.45
MAOA P21397 1/20 0.45
LMNA P02545 2/20 0.41
ALDH1A1 P00352 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAPK1 P28482 1/20 0.40
POLB P06746 1/20 0.38
LDHA P00338 1/20 0.38
LDHB P07195 1/20 0.38
HSD11B1 P28845 1/20 0.38
HTT P42858 1/20 0.38
EPHX2 P34913 1/20 0.37
TSHR P16473 1/20 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
SCHEMBL4419259 0.92 MAOB (0.53) MAOBMAOAALDH1A1NPSR1HPGD
SCHEMBL4414455 0.90 EPHX2 (0.48) MAOBMAOALMNAALDH1A1NPSR1
SCHEMBL4423693 0.88 MAPK1 (0.44) MAOBMAOALMNAALDH1A1NPSR1
SCHEMBL4417872 0.88 ALDH1A1 (0.45) MAOBLMNAALDH1A1NPSR1HPGD
SCHEMBL4419968 0.88 L3MBTL1 (0.46) MAOBLMNAALDH1A1NPSR1HPGD
SCHEMBL4425278 0.86 ALDH1A1 (0.43) MAOBMAOALMNAALDH1A1NPSR1
SCHEMBL4414933 0.86 KMT2A (0.43) MAOBMAOALMNAALDH1A1NPSR1
SCHEMBL4425190 0.86 MEN1 (0.46) LMNAALDH1A1NPSR1HPGDKMT2A
SCHEMBL4422644 0.85 USP30 (0.46) MAOBMAOALMNAALDH1A1KMT2A
SCHEMBL4413584 0.85 ALDH1A1 (0.48) LMNAALDH1A1KMT2ASMN1; SMN2POLB

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 MAOB 307/4885MAOA 726/4885LMNA 4565/4885

“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.