SCHEMBL7145565

SCHEMBL7145565

C=CCC1(C2C=CCCC2)N=C(c2ccccc2)OC1=O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MYC P01106 2/20 0.34
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL7098911 0.78 MYC (0.43) ALDH1A1MAPTHPGDMEN1MAPK1
SCHEMBL7103220 0.77 ALDH1A1 (0.42) ALDH1A1MAPTHPGDMEN1MAPK1
SCHEMBL7103217 0.77 ALDH1A1 (0.42) ALDH1A1MAPTHPGDMEN1MAPK1
SCHEMBL7102630 0.77 ALDH1A1 (0.42) ALDH1A1MAPTHPGDMEN1MAPK1
SCHEMBL7098891 0.74 ALDH1A1 (0.40) ALDH1A1MAPTHPGDMEN1MAPK1
SCHEMBL25492017 0.70 ALDH1A1 (0.40) ALDH1A1MAPTHPGDMEN1MAPK1
SCHEMBL8031048 0.68 ALDH1A1 (0.40) ALDH1A1MAPTHPGDMEN1MAPK1
SCHEMBL11274712 0.65 MAPT (0.37) ALDH1A1MAPTHPGDMEN1MAPK1
SCHEMBL7103455 0.65 MYC (0.39) ALDH1A1MAPTHPGDMEN1MAPK1
SCHEMBL25492146 0.64 ALDH1A1 (0.36) ALDH1A1MAPTHPGDMEN1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0977742-B1 THE PREPARATION OF ENANTIOMERICALLY ENRICHED OXAZOLONES AND ALPHA, ALPHA-DISUBSTITUTED AMINO ACIDS UNIV LELAND STANFORD JUNIOR (US) 2003-09-10 EP disclosed
US-6130337-A ALKYLATING AN ALLYLIC ELECTROPHILE WITH A 5-OXAZOLONE IN PRESENCE OF A BASE BOARD OF TRUSTEES OF LELAND STANFORD JUNIOR UNIVERSITY (US) 2000-10-10 US disclosed
EP-0977742-A1 THE PREPARATION OF ENANTIOMERICALLY ENRICHED OXAZOLONES AND ALPHA, ALPHA-DISUBSTITUTED AMINO ACIDS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2000-02-09 EP disclosed
WO-1998046578-A1 THE PREPARATION OF ENANTIOMERICALLY ENRICHED OXAZOLONES AND α,α-DISUBSTITUTED AMINO ACIDS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1998-10-22 WO disclosed