SCHEMBL14408604

SCHEMBL14408604

COC1O[C@H](CO)C(NC2C=C(CO)[C@@H](O)C(O)[C@@H]2O)[C@H](O)[C@@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MGAM O43451 8/20 1.00
SI P14410 7/20 1.00
AMY2A P04746 7/20 0.64
GAA P10253 4/20 0.64
AMY1A P0DUB6 3/20 0.64
CNR1 P21554 1/20 0.64
PTGS1 P23219 1/20 0.64
PDE4A P27815 1/20 0.64
PDE3A Q14432 1/20 0.64
MGAM2 Q2M2H8 1/20 0.64
ALDH1A1 P00352 1/20 0.64
GLA P06280 1/20 0.64
TREH O43280 1/20 0.51

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
SCHEMBL14408687 1.00 MGAM (1.00) MGAMSIAMY2AGAAAMY1A
SCHEMBL14408482 1.00 MGAM (1.00) MGAMSIAMY2AGAAAMY1A
SCHEMBL14408690 1.00 MGAM (1.00) MGAMSIAMY2AGAAAMY1A
SCHEMBL5158177 1.00 MGAM (1.00) MGAMSIAMY2AGAAAMY1A
SCHEMBL14408695 1.00 MGAM (1.00) MGAMSIAMY2AGAAAMY1A
SCHEMBL30937784 1.00 MGAM (1.00) MGAMSIAMY2AGAAAMY1A
SCHEMBL14408702 1.00 MGAM (1.00) MGAMSIAMY2AGAAAMY1A
SCHEMBL17771361 0.92 MGAM (0.85) MGAMSIAMY2AGAAAMY1A
SCHEMBL18157143 0.92 MGAM (0.85) MGAMSIAMY2AGAAAMY1A
SCHEMBL14408475 0.91 MGAM (0.84) MGAMSIAMY2AGAAAMY1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7271158-B2 Treatment of rumen acidosis with α-amylase inhibitors PFIZER INC. (US) 2007-09-18 US disclosed
US-7271158-B2 Treatment of rumen acidosis with α-amylase inhibitors PFIZER INC. (US) 2007-09-18 US disclosed