SCHEMBL8680601

SCHEMBL8680601

CCC[C@H](NC(=O)[C@H](C)N)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 5/20 0.51
▸ MME P08473 2/20 0.49
▸ DPP8 Q6V1X1 1/20 0.49
▸ DPP7 Q9UHL4 1/20 0.49
▸ SLC15A1 P46059 1/20 0.44
▸ ACE P12821 1/20 0.43
▸ FPR2 P25090 1/20 0.43
▸ DPP4 P27487 1/20 0.42
▸ CHRM1 P11229 1/20 0.40
▸ AKR1A1 P14550 1/20 0.40
▸ CHRM3 P20309 1/20 0.40
▸ HTR2A P28223 1/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ ADRA1A P35348 1/20 0.40
▸ HRH1 P35367 1/20 0.40
▸ DRD3 P35462 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL8680597 1.00 NOD1 (0.51) NOD1MMEDPP8DPP7SLC15A1
SCHEMBL29898351 0.89 DPP7 (0.58) NOD1MMEDPP8DPP7SLC15A1
SCHEMBL15757005 0.89 DPP7 (0.58) NOD1MMEDPP8DPP7SLC15A1
SCHEMBL29476436 0.89 DPP7 (0.58) NOD1MMEDPP8DPP7SLC15A1
SCHEMBL15757004 0.89 DPP7 (0.58) NOD1MMEDPP8DPP7SLC15A1
SCHEMBL8492399 0.85 DPP4 (0.51) NOD1MMEDPP8DPP7ACE
SCHEMBL29406348 0.85 NOD1 (0.51) NOD1DPP8DPP7ACEDPP4
SCHEMBL8495663 0.85 DPP8 (0.51) NOD1MMEDPP8DPP7SLC15A1
SCHEMBL2854257 0.85 DPP8 (0.51) NOD1MMEDPP8DPP7SLC15A1
SCHEMBL31181279 0.85 NOD1 (0.51) NOD1MMEDPP8DPP7ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5757408-A PRINTING IMAGE ON SUBSTRATE COATED WITH AMINO-ACID DERIVATIVE ADDITIVE; QUICK DRYING OF INK, OPTICAL DENSITY, NONCURLING XEROX CORPORATION (US) 1998-05-26 — — US claimed
US-5683793-A Ink jet transparencies XEROX CORPORATION (US) 1997-11-04 — — US claimed
US-5589277-A INK JET PRINTING, AQUEOUS INKS, FAST DRYING XEROX CORPORATION (US) 1996-12-31 — — US claimed
EP-0667246-A1 Recording sheets containing amino acids, hydroxy acids, and polycarboxyl compounds XEROX CORPORATION (US) 1995-08-16 — — EP claimed
EP-0667246-A1 Recording sheets containing amino acids, hydroxy acids, and polycarboxyl compounds XEROX CORPORATION (US) 1995-08-16 — — EP disclosed
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