SCHEMBL27622754

SCHEMBL27622754

CCCCON(C=O)[C@H](CO)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.34
HCAR2 Q8TDS4 2/20 0.34
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MAPK1 P28482 2/20 0.31
CA2 P00918 1/20 0.31
SLC1A3 P43003 1/20 0.30
SLC1A2 P43004 1/20 0.30
SLC1A1 P43005 1/20 0.30
MAPT P10636 1/20 0.30
CNR1 P21554 1/20 0.30
GPR84 Q9NQS5 2/20 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
SCHEMBL27520966 1.00 ATM (0.34) ATMHCAR2HPGDTSHRALDH1A1
SCHEMBL7812418 0.83 TSHR (0.37) ATMHCAR2HPGDTSHRALDH1A1
Hydrochloric Acid SCHEMBL8564310 0.82 SLC1A2 (0.33) ATMHCAR2MAPK1CA2SLC1A3
SCHEMBL27930505 0.80 ATM (0.36) ATMHCAR2HPGDTSHRALDH1A1
SCHEMBL4758659 0.78
SCHEMBL27654740 0.77 ATM (0.34) ATMHCAR2HPGDTSHRALDH1A1
SCHEMBL27452646 0.73 CA1 (0.34) ATMHPGDTSHRALDH1A1CA2
SCHEMBL27489473 0.73 PTGES (0.42) TSHRALDH1A1MAPT
SCHEMBL18375524 0.72 ALDH1A1 (0.36) ALDH1A1MAPK1CA2SLC1A2SLC1A1
SCHEMBL27383827 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1681936-A Process for producing optically active erythro 3-cyclohexylserines NIPPON KAYAKU KK (JP) 2005-10-12 CN disclosed