SCHEMBL27634976

SCHEMBL27634976

NC(=O)CC(N)n1cnc(C[C@H](N)C(=O)O)c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.39
▸ SLC1A3 P43003 1/20 0.36
▸ SLC7A5 Q01650 3/20 0.36
▸ ALPI P09923 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ PTGS1 P23219 1/20 0.36
▸ XIAP P98170 1/20 0.36
▸ TYR P14679 5/20 0.35
▸ GRIA1 P42261 3/20 0.35
▸ GRIA2 P42262 3/20 0.35
▸ GRIA3 P42263 3/20 0.35
▸ GRIA4 P48058 3/20 0.35
▸ CPB2 Q96IY4 3/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CPB1 P15086 2/20 0.34

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
SCHEMBL19750174 0.81 CPB2 (0.46) CYP1A2SLC1A3SLC7A5ALPIPKM
SCHEMBL28167184 0.80 CYP1A2 (0.39) CYP1A2SLC1A3SLC7A5ALPIPKM
SCHEMBL9118915 0.79 CYP1A2 (0.38) CYP1A2SLC1A3SLC7A5ALPIPKM
SCHEMBL6905691 0.78 CYP1A2 (0.35) CYP1A2SLC1A3SLC7A5ALPIPKM
SCHEMBL503556 0.77 CYP1A2 (0.44) CYP1A2SLC1A3SLC7A5ALPIPKM
SCHEMBL358922 0.77 CYP1A2 (0.44) CYP1A2SLC1A3SLC7A5ALPIPKM
SCHEMBL27974517 0.77 CYP1A2 (0.46) CYP1A2SLC1A3SLC7A5ALPIPKM
Water SCHEMBL1507364 0.76 CYP1A2 (0.43) CYP1A2SLC1A3SLC7A5ALPIPKM
Hydrochloric Acid SCHEMBL14831326 0.76 CYP1A2 (0.43) CYP1A2SLC1A3SLC7A5ALPIPKM
Water SCHEMBL3639234 0.76 CYP1A2 (0.43) CYP1A2SLC1A3SLC7A5ALPIPKM

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
CN-100488488-C biological activator of skin metabolism THOREL JEAN NOEL (FR) 2009-05-20 — — CN claimed
CN-1731973-A biological activator of skin metabolism THOREL JEAN NOEL (FR) 2006-02-08 — — CN claimed
CN-102697680-A Application and products of plant hormones in anti-wrinkle care products of skin GUANGDONG MINGCHEN CO LTD 2012-10-03 — — CN disclosed
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