SCHEMBL30437074

SCHEMBL30437074

CC(C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)O)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHA2 P29317 2/20 0.41
▸ GRB2 P62993 1/20 0.40
▸ ACE P12821 7/20 0.40
▸ REN P00797 4/20 0.40
▸ CTSK P43235 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ F2 P00734 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ LTA4H P09960 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ PEPD P12955 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ PTGS1 P23219 1/20 0.38
▸ HTR2A P28223 1/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ HRH1 P35367 1/20 0.38
▸ THPO P40225 1/20 0.38
▸ PMP22 Q01453 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ ACE2 Q9BYF1 1/20 0.38

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
SCHEMBL31437158 0.95 ACE (0.43) EPHA2GRB2ACERENKDM4E
SCHEMBL31467772 0.91 EPHA2 (0.41) EPHA2OPRM1OPRK1KDM1A
SCHEMBL29411971 0.90 OPRK1 (0.46) GRB2ACEOPRM1OPRK1
SCHEMBL29994788 0.90 OPRK1 (0.46) GRB2ACEOPRM1OPRK1
SCHEMBL30671934 0.88 ACE (0.45) GRB2ACERENKDM4EF2
SCHEMBL31419820 0.87 NTSR2 (0.44) KDM1ATGM2
SCHEMBL9537011 0.87 EPHA2 (0.43) EPHA2GRB2CTSK
SCHEMBL9537049 0.87 EPHA2 (0.43) EPHA2GRB2CTSK
SCHEMBL31487371 0.86 GRB2 (0.53) EPHA2GRB2OPRM1OPRK1
SCHEMBL31437202 0.86 OPRM1 (0.46) EPHA2OPRM1OPRK1KDM1A

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-4436538-A1 COSMETIC OR PHARMACEUTICAL PREPARATION FOR SKIN CARE AND IMPROVING SKIN CONDITION Merryvital AG (CH) 2024-10-02 — — EP disclosed
CN-118401224-A Cosmetic or cosmeceutical product for skin care and improving skin condition 迈瑞维拓股份公司 2024-07-26 — — CN disclosed
WO-2023094852-A1 COSMETIC OR PHARMACEUTICAL PREPARATION FOR SKIN CARE AND IMPROVING SKIN CONDITION MERRYVITAL AG (CH) 2023-06-01 — — WO disclosed
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