SCHEMBL7445995

SCHEMBL7445995

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

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
CTSC P53634 4/20 0.47
POLB P06746 1/20 0.47
LMNA P02545 2/20 0.46
ATM Q13315 1/20 0.46
ALDH1A1 P00352 2/20 0.44
ANPEP P15144 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
NAALAD2 Q9Y3Q0 1/20 0.43
FOLH1 Q04609 1/20 0.43
GAA P10253 1/20 0.43
ACACB O00763 1/20 0.43
EPHX2 P34913 1/20 0.43
CTSS P25774 1/20 0.43
CTSK P43235 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
SCHEMBL9852783 0.84 KMT2A (0.59) NPC1RAB9AANPEPEPHX2
SCHEMBL27698308 0.81 CTSC (0.54) NPC1RAB9ACTSCLMNAALDH1A1
SCHEMBL334301 0.81 CTRB1 (0.57) NPC1RAB9ACTSCLMNAACACB
SCHEMBL2843211 0.81 CTRB1 (0.57) NPC1RAB9ACTSCLMNAACACB
SCHEMBL334424 0.81 CTRB1 (0.57) NPC1RAB9ACTSCLMNAACACB
SCHEMBL12204095 0.80 NPC1 (0.77) NPC1RAB9ALMNAGAAACACB
SCHEMBL10429991 0.80 LMNA (0.67) POLBLMNAATMALDH1A1ANPEP
SCHEMBL26258443 0.80 NPC1 (0.77) NPC1RAB9ALMNAGAAACACB
SCHEMBL9852735 0.79 ANPEP (0.49) ANPEPCTSSCTSK
SCHEMBL6292023 0.78 NPC1 (0.47) NPC1RAB9ACTSCPOLBATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0748333-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2000-05-10 EP disclosed
EP-0748333-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1996-12-18 EP disclosed
WO-1995023809-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1995-09-08 WO disclosed