SCHEMBL7293175

SCHEMBL7293175

C=CNC(=O)C1CCCCN1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRCP P42785 3/20 0.41
HTR2C P28335 3/20 0.38
HTR2B P41595 1/20 0.38
ULK1 O75385 1/20 0.37
DPP7 Q9UHL4 1/20 0.36
CTSC P53634 3/20 0.35
CTSK P43235 1/20 0.35
KCNH2 Q12809 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
TSHR P16473 1/20 0.35
HDAC2 Q92769 1/20 0.34
NOS2 P35228 2/20 0.34
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
DPP4 P27487 1/20 0.33
PSMB8 P28062 1/20 0.33

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
SCHEMBL15962430 0.78 PRCP (0.46) PRCPHTR2CHTR2BULK1DPP7
SCHEMBL2143309 0.77 KMT2A (0.53) PRCPHTR2CHTR2BDPP7
SCHEMBL8959045 0.77 PRCP (0.46) PRCPHTR2CHTR2BDPP7CTSC
SCHEMBL19815565 0.76 HDAC8 (0.46) PRCPHTR2CHTR2BULK1DPP7
SCHEMBL3806378 0.76 HDAC8 (0.46) PRCPHTR2CHTR2BULK1DPP7
SCHEMBL29572383 0.76 HDAC8 (0.46) PRCPHTR2CHTR2BULK1DPP7
SCHEMBL1965000 0.75 PRCP (0.47) PRCPHTR2CHTR2BULK1DPP7
SCHEMBL22221409 0.75 PRCP (0.47) PRCPHTR2CHTR2BULK1DPP7
SCHEMBL13306379 0.75 PRCP (0.47) PRCPHTR2CHTR2BULK1DPP7
SCHEMBL29288134 0.75 PRCP (0.44) PRCPHTR2CHTR2BULK1DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5583133-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1996-12-10 US claimed
US-5532232-A INHIBIT THROMBIN INDUCED PLATELET AGGREGATION; FIBRINOGEN ANTICOAGULANTS IN BLOOD HOFFMANN-LA ROCHE INC. (US) 1996-07-02 US claimed
EP-0468231-B1 Guanidins HOFFMANN LA ROCHE (CH) 1994-09-21 EP claimed
US-5763436-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1998-06-09 US disclosed
US-5595999-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1997-01-21 US disclosed
US-5583133-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1996-12-10 US disclosed
US-5532232-A INHIBIT THROMBIN INDUCED PLATELET AGGREGATION; FIBRINOGEN ANTICOAGULANTS IN BLOOD HOFFMANN-LA ROCHE INC. (US) 1996-07-02 US disclosed
US-5393760-A Cardiovascular disorders, antitumor agents HOFFMANN-LA ROCHE INC. (US) 1995-02-28 US disclosed
US-5260307-A Inhibit thrombin-induced platlet aggregation and clotting of fibrogen in plasma HOFMANN-LA ROCHE INC. (US) 1993-11-09 US disclosed