SCHEMBL8069933

SCHEMBL8069933

CCC(C)[C@H](NCc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.57
ALDH1A1 P00352 3/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
ATM Q13315 1/20 0.49
SIGMAR1 Q99720 1/20 0.49
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
ACE P12821 2/20 0.48
MME P08473 1/20 0.48
CPA1 P15085 1/20 0.48
ACE2 Q9BYF1 1/20 0.48
POLB P06746 2/20 0.48
MAPT P10636 1/20 0.46

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
SCHEMBL18782332 1.00 ANPEP (0.57) ANPEPALDH1A1MEN1KMT2AATM
SCHEMBL5658130 1.00 ANPEP (0.57) ANPEPALDH1A1MEN1KMT2AATM
SCHEMBL5658127 1.00 ANPEP (0.57) ANPEPALDH1A1MEN1KMT2AATM
SCHEMBL27487680 0.89 ANPEP (0.53) ANPEPALDH1A1MEN1KMT2ASIGMAR1
SCHEMBL7284516 0.89 ANPEP (0.53) ANPEPALDH1A1MEN1KMT2ASIGMAR1
SCHEMBL10448479 0.89 ANPEP (0.53) ANPEPALDH1A1MEN1KMT2ASIGMAR1
Hydrochloric Acid SCHEMBL8617719 0.87 ANPEP (0.52) ANPEPMEN1KMT2ASIGMAR1
SCHEMBL4170192 0.87 TRPM8 (0.55) ANPEPALDH1A1MEN1KMT2AATM
SCHEMBL4166663 0.87 TRPM8 (0.55) ANPEPALDH1A1MEN1KMT2AATM
Hydrochloric Acid SCHEMBL27488757 0.87 ANPEP (0.52) ANPEPMEN1KMT2ASIGMAR1

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
EP-0853612-B1 ALPHA-HYDRAZINO ACID DERIVATIVES AND METHOD FOR MAKING SAME CENTRE NAT RECH SCIENT (FR) 2000-06-14 EP disclosed
US-5962722-A α-hydrazino acid derivatives and method for making same CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1999-10-05 US disclosed
EP-0853612-A1 ALPHA-HYDRAZINO ACID DERIVATIVES AND METHOD FOR MAKING SAME CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1998-07-22 EP disclosed
WO-1997009303-A1 ALPHA-HYDRAZINO ACID DERIVATIVES AND METHOD FOR MAKING SAME CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1997-03-13 WO disclosed
WO-1997005126-A1 MUPIROCINSULFAMATES WITH ANTIBACTERIAL ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1997-02-13 WO disclosed