SCHEMBL9829066

SCHEMBL9829066

CCCCCN[C@@](C)(CO)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 9/20 0.41
NAAA Q02083 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
CASP2 P42575 1/20 0.37
HPGD P15428 1/20 0.36
AKR1B1 P15121 1/20 0.35
ALOX15 P16050 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
ZDHHC20 Q5W0Z9 1/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35
PLA2G2A P14555 1/20 0.35
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 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
SCHEMBL19480055 0.89 EPHX2 (0.49) ALOX15
SCHEMBL5426320 0.83 EPHX1 (0.44) EPHX1NAAACASP2ZDHHC20ZDHHC2
SCHEMBL31477734 0.80 ALOX15 (0.42) EPHX1SMN1; SMN2AKR1B1ALOX15KDM4C
SCHEMBL29382795 0.79 NAALAD2 (0.51) AKR1B1ALOX15PLA2G2AALDH1A1TSHR
SCHEMBL3885213 0.78 KDM4C (0.47) EPHX1NAAACASP2AKR1B1ALOX15
SCHEMBL23052825 0.78 MEN1 (0.36) ALOX15ALDH1A1TSHR
SCHEMBL20999124 0.77 TSHR (0.39) KDM4CALDH1A1TSHR
SCHEMBL22487748 0.77 TSHR (0.39) KDM4CALDH1A1TSHR
SCHEMBL10207220 0.77 TSHR (0.39) KDM4CALDH1A1TSHR
SCHEMBL23177887 0.76 MEN1 (0.35) ALOX15ALDH1A1TSHR

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-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP disclosed