SCHEMBL9508408

SCHEMBL9508408

CC1(C(=O)NCC(=O)O)CC1(Cl)Cl

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
NPSR1 Q6W5P4 1/20 0.61
GAA P10253 1/20 0.43
MME P08473 2/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
RAB9A P51151 1/20 0.41
LMNA P02545 1/20 0.40
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
KDM4E B2RXH2 1/20 0.37
EGLN1 Q9GZT9 1/20 0.36

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
SCHEMBL1136202 0.79 HPGD (0.66) HPGDSMN1; SMN2NPSR1GAAMEN1
SCHEMBL20415657 0.73 MME (0.47) HPGDSMN1; SMN2NPSR1MMECYP3A4
SCHEMBL28306633 0.72 MME (0.50) MMEKMT2ACYP3A4CYP2C19LMNA
SCHEMBL12858044 0.72 TSHR (0.68) SMN1; SMN2GAAMMERAB9ALMNA
SCHEMBL7102263 0.68 ALDH1A1 (0.45) NPSR1MMEMEN1KMT2ACYP3A4
SCHEMBL7102260 0.68 ALDH1A1 (0.45) NPSR1MMEMEN1KMT2ACYP3A4
SCHEMBL3000839 0.68 MME (0.42) MMEKMT2ALMNAALDH1A1TSHR
SCHEMBL1651948 0.68 MME (0.55) SMN1; SMN2MMECYP3A4CYP2C19LMNA
SCHEMBL21410865 0.68
SCHEMBL7693995 0.68

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-0398059-B1 CYCLOPROPANOYLAMINOACID AMIDE DERIVATIVES BAYER AG (DE) 1993-08-25 EP disclosed
US-5034408-A Fungicides of dihalocyclopropanoylamino acid amides BAYER AKTIENGESELLSCHAFT (DE) 1991-07-23 US disclosed
EP-0398059-A1 Cyclopropanoylaminoacid amide derivatives BAYER AG (DE) 1990-11-22 EP disclosed