SCHEMBL7303552

SCHEMBL7303552

CSCC[C@H](N)C(=O)NC(c1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSC P53634 2/20 0.48
FNTA P49354 4/20 0.45
FNTB P49356 4/20 0.45
PGGT1B P53609 3/20 0.45
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
ANPEP P15144 1/20 0.43

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
SCHEMBL7313421 0.87 POLB (0.55) CTSC
SCHEMBL7313409 0.87 POLB (0.55) CTSC
SCHEMBL7374474 0.87 MMP2 (0.47) CTSCFNTAFNTBPGGT1BTSHR
SCHEMBL7305453 0.83 CNR1 (0.57) CTSCFNTAFNTBPGGT1B
SCHEMBL11130907 0.81 ANPEP (0.48) FNTAFNTBPGGT1BTSHRANPEP
SCHEMBL11130908 0.81 ANPEP (0.48) FNTAFNTBPGGT1BTSHRANPEP
SCHEMBL7317840 0.81 CTSC (0.51) CTSCFNTAFNTBPGGT1BANPEP
SCHEMBL7313784 0.81 POLB (0.55) LMNATSHR
SCHEMBL7313780 0.81 POLB (0.55) LMNATSHR
SCHEMBL11104392 0.80 DPP4 (0.50) LMNATSHR

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
EP-1041064-A2 N-substituted alpha aminoacid amides as calcium channel modulators ELI LILLY AND COMPANY LIMITED (GB) 2000-10-04 EP disclosed
EP-0805147-A1 Novel N-substituted alpha aminoacid amides as calcium channel modulators LILLY INDUSTRIES LIMITED (GB) 1997-11-05 EP disclosed