SCHEMBL4419952

SCHEMBL4419952

CC(C)(C)OC(=O)N1CC2C(C1)C2CN(C(=O)c1cccs1)c1ccc(N2CCOCC2)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.49
KMT2A Q03164 4/20 0.45
NPC1 O15118 4/20 0.45
RAB9A P51151 3/20 0.45
MAOB P27338 1/20 0.43
GPR119 Q8TDV5 2/20 0.40
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
F10 P00742 1/20 0.36

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
SCHEMBL2169077 0.87 KMT2A (0.44) USP30KMT2ANPC1RAB9AMAOB
SCHEMBL2170216 0.87 NPC1 (0.43) USP30KMT2ANPC1RAB9AMAOB
SCHEMBL2169218 0.85 KMT2A (0.42) USP30KMT2ANPC1RAB9AMAOB
SCHEMBL2167706 0.85 KMT2A (0.41) USP30KMT2ANPC1RAB9AMAOB
SCHEMBL2170320 0.84 NPC1 (0.44) USP30KMT2ANPC1RAB9AMAOB
SCHEMBL2183187 0.84 NPC1 (0.48) USP30KMT2ANPC1RAB9AMAOB
SCHEMBL2167434 0.84 NPC1 (0.41) USP30KMT2ANPC1RAB9AMAOB
SCHEMBL2180812 0.84 NPC1 (0.43) USP30KMT2ANPC1RAB9AMAOB
SCHEMBL2168713 0.84 KMT2A (0.43) USP30KMT2ANPC1RAB9AMAOB
SCHEMBL2169356 0.83 MAOB (0.48) USP30KMT2ANPC1RAB9AMAOB

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 6 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 disclosed
EP-1680124-A4 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS PFIZER PROD INC (US) 2009-05-13 EP disclosed
US-7473787-B2 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors PFIZER INC (US) 2009-01-06 US disclosed
EP-1680124-A2 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS Pfizer Products Incorporated (US) 2006-07-19 EP disclosed
US-20050096375-A1 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors PFIZER INC. 2005-05-05 US disclosed
WO-2005037216-A2 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS PFIZER PRODUCTS INC. (US) 2005-04-28 WO 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 USP30 4095/4885KMT2A 1892/4885NPC1 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.