SCHEMBL24201035

SCHEMBL24201035

CNC(Cc1ccccc1)C(=O)N(C)CC(=O)NC(CC1=CCCC=C1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.42
RAB9A P51151 1/20 0.40
LMNA P02545 1/20 0.39
PTPN1 P18031 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MME P08473 2/20 0.38
CPA1 P15085 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
POLB P06746 1/20 0.38
HSD17B10 Q99714 1/20 0.37
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37
MMP14 P50281 1/20 0.37
ECE1 P42892 1/20 0.37

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
SCHEMBL22457558 0.86 ACE (0.53) ACERAB9ALMNAPTPN1MME
SCHEMBL12069766 0.77 ACE (0.50) ACELMNAALDH1A1MMEL3MBTL1
SCHEMBL29814575 0.73 ACE (0.53) ACELMNAPTPN1MMEL3MBTL1
SCHEMBL16254314 0.72 HPGD (0.65) RAB9ALMNAMMP9MMP8MMP14
SCHEMBL7328042 0.72 ACE (0.57) ACELMNAPTPN1MMECPA1
SCHEMBL29860964 0.72 CTSL (0.61) ALDH1A1
SCHEMBL7289252 0.71 PTPN1 (0.56) ACELMNAPTPN1ALDH1A1MME
SCHEMBL23869542 0.70
SCHEMBL12205303 0.70 ACE (0.50) ACELMNAPTPN1MMEL3MBTL1
SCHEMBL10102757 0.69 PTPN1 (0.37) ACEPTPN1ALDH1A1MMECPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3939959-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND Nissan Chemical Corporation (JP) 2022-01-19 EP disclosed