SCHEMBL6432779

SCHEMBL6432779

C=CCCCCCCCCCN[C@@H](CC(C)C)C(=O)O.[NaH]

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.41
▸ MAPT P10636 4/20 0.40
▸ ABCC4 O15439 1/20 0.40
▸ LMNA P02545 3/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ PLA2G2A P14555 2/20 0.38
▸ PLA2G5 P39877 2/20 0.38
▸ FOLH1 Q04609 3/20 0.36
▸ USP2 O75604 2/20 0.35
▸ CYP3A4 P08684 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ RECQL P46063 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ LAP3 P28838 2/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ PLA2G10 O15496 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
SCHEMBL2511764 0.85 ALDH1A1 (0.53) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL6430176 0.81 PLA2G2A (0.56) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL6431816 0.81 PLA2G2A (0.56) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL13279454 0.81 PLA2G2A (0.56) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL13279452 0.81 PLA2G2A (0.56) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL27845785 0.81 PLA2G10 (0.53) ALDH1A1MAPTLMNAKMT2APLA2G2A
SCHEMBL29141163 0.81 PLA2G10 (0.53) ALDH1A1MAPTLMNAKMT2APLA2G2A
SCHEMBL25335826 0.79 PLA2G2A (0.58) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL11796883 0.79 PLA2G2A (0.58) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL8674366 0.79 PLA2G2A (0.58) ALDH1A1MAPTLMNAMEN1KMT2A

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
US-6849722-B2 Polymerized oligopeptide-surfactant chiral micelles BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2005-02-01 — — US disclosed
US-20010051703-A1 Polymerized oligopeptide-surfactant chiral micelles NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2001-12-13 — — US disclosed
US-6270640-B1 SEPARATING A MIXTURE OF TWO ENENTIOMERS WHERE DIFFERENT AFFINITIES CAUSE THEM TO MOVE THROUGH THE POLYMERIZED DIPEPTIDE CHIRAL MICELLE AT DIFFERENT VELOCITIES BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE 2001-08-07 — — US disclosed
Send feedback