SCHEMBL4415448

SCHEMBL4415448

O=C(Nc1ccc(N2CCOCC2)c(F)c1)C1C2CN(Cc3ccc(CO)o3)CC21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
HTT P42858 2/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
USP30 Q70CQ3 1/20 0.42
DGAT1 O75907 1/20 0.42
LMNA P02545 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
MAOB P27338 2/20 0.41
LDHA P00338 1/20 0.41
LDHB P07195 1/20 0.41
MTOR P42345 1/20 0.40
POLB P06746 1/20 0.40
MAOA P21397 1/20 0.40
PTGS1 P23219 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
SCHEMBL4412368 0.84 MAPT (0.53) L3MBTL1HTTNPC1RAB9AMAPT
SCHEMBL4415452 0.84 L3MBTL1 (0.41) L3MBTL1HTTNPC1RAB9AMAPT
SCHEMBL4417594 0.83 L3MBTL1 (0.48) L3MBTL1HTTNPC1RAB9AMAPT
SCHEMBL2170675 0.83 L3MBTL1 (0.52) L3MBTL1HTTNPC1RAB9AMAPT
SCHEMBL4423905 0.83 HTT (0.60) L3MBTL1HTTNPC1RAB9AMAPT
SCHEMBL4418119 0.82 NPC1 (0.48) L3MBTL1HTTNPC1RAB9AMAPT
SCHEMBL4425784 0.82 NPC1 (0.60) L3MBTL1HTTNPC1RAB9AMAPT
SCHEMBL4414909 0.81 HIF1A (0.54) L3MBTL1HTTNPC1RAB9AMAPT
SCHEMBL4423641 0.81 NPC1 (0.49) L3MBTL1HTTNPC1RAB9AMAPT
SCHEMBL2180733 0.81 NPC1 (0.50) L3MBTL1HTTNPC1RAB9AMAPT

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 L3MBTL1 1416/4885HTT 1090/4885NPC1 301/4885

“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.