SCHEMBL7376264

SCHEMBL7376264

CCOC(=O)C1CNCCN1c1ccc(N)cc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LGMN Q99538 2/20 0.40
MAPT P10636 2/20 0.39
PKM P14618 1/20 0.39
LMNA P02545 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAOA P21397 1/20 0.39
PDE4D Q08499 1/20 0.38
PPIB P23284 1/20 0.36
ALDH1A1 P00352 2/20 0.36
KMT2A Q03164 1/20 0.36
F2 P00734 1/20 0.35
F10 P00742 1/20 0.35
SHMT2 P34897 1/20 0.35
RAB9A P51151 1/20 0.34

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
SCHEMBL5388810 0.88 ALDH1A1 (0.42) MAPTPKMLMNAALDH1A1KMT2A
SCHEMBL8944811 0.87 MAPT (0.49) MAPTPKMALDH1A1KMT2ARAB9A
SCHEMBL5389244 0.84 ALDH1A1 (0.51) ALDH1A1
SCHEMBL14711764 0.81 F10 (0.47) LGMNMAPTLMNACYP1A2CYP3A4
SCHEMBL5922625 0.80 ALDH1A1 (0.46) MAPTLMNACYP1A2CYP3A4ALDH1A1
SCHEMBL79066 0.80 F10 (0.51) LGMNLMNACYP1A2CYP3A4MAOA
SCHEMBL2386901 0.78 LGMN (0.46) LGMNMAPTLMNACYP1A2CYP3A4
SCHEMBL6543170 0.77 HTT (0.42) ALDH1A1
SCHEMBL5390197 0.74 ALDH1A1 (0.41) MAPTPKMALDH1A1KMT2A
SCHEMBL5408982 0.74 TACR1 (0.57) MAPTPKMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6069143-A Fibrinogen receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 2000-05-30 US disclosed
EP-0885213-A4 FIBRINOGEN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 1999-04-28 EP disclosed
EP-0885213-A1 FIBRINOGEN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1998-12-23 EP disclosed
WO-1997025323-A1 FIBRINOGEN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-07-17 WO disclosed