SCHEMBL7170754

SCHEMBL7170754

N=C(N)N[C@H](C=O)Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 7/20 0.54
CTSB P07858 4/20 0.50
ACE P12821 1/20 0.49
CTSL P07711 1/20 0.46

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
SCHEMBL7170752 1.00 CAPN1 (0.54) CAPN1CTSBACECTSL
SCHEMBL2911854 0.85 CAPN1 (0.58) CAPN1CTSBACE
SCHEMBL14663480 0.82 CAPN1 (0.59) CAPN1CTSBACECTSL
SCHEMBL14663479 0.82 CAPN1 (0.59) CAPN1CTSBACECTSL
SCHEMBL2369340 0.81 CAPN1 (0.61) CAPN1CTSBACE
SCHEMBL3292711 0.81 CAPN1 (0.61) CAPN1CTSBACE
SCHEMBL17865652 0.81 CAPN1 (0.61) CAPN1CTSBACE
SCHEMBL16485210 0.79 CTSC (0.57) CAPN1CTSBACE
SCHEMBL10045690 0.78 CAPN1 (0.58) CAPN1CTSBACE
SCHEMBL2269431 0.78 CAPN1 (0.58) CAPN1CTSBACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6576613-B1 Arginine derivatives; monitoring plasminogen activator levels; inhibiting angiogenesis and tumor cell growth CORVAS INTERNATIONAL, INC. 2003-06-10 US disclosed
US-6432922-B1 ANTITUMOR AGENTS; ANGIOGENESIS INHIBITORS CORVAS INTERNATIONAL, INC. 2002-08-13 US disclosed