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Sugi Predict / Compounds / SCHEMBL5333550

SCHEMBL5333550

SCHEMBL5333550

OC[C@H]1O[C@@H](O)[C@H](Oc2cn(Cl)c3ccccc23)[C@@H](O)[C@@H]1O

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.40
▸ SLC5A2 P31639 9/20 0.40
▸ SLC5A1 P13866 2/20 0.40
▸ EPHX2 P34913 1/20 0.37
▸ CD209 Q9NNX6 1/20 0.35

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
SCHEMBL6273047 1.00 ATM (0.40) ATMSLC5A2SLC5A1EPHX2CD209
SCHEMBL22492210 1.00 ATM (0.40) ATMSLC5A2SLC5A1EPHX2CD209
SCHEMBL14892463 0.86 ATM (0.40) ATMSLC5A2SLC5A1EPHX2CD209
SCHEMBL3648218 0.86 SLC5A2 (0.42) ATMSLC5A2SLC5A1EPHX2
SCHEMBL22412720 0.86 SLC5A2 (0.42) ATMSLC5A2SLC5A1EPHX2
SCHEMBL154170 0.85 ATM (0.40) ATMSLC5A2SLC5A1EPHX2
SCHEMBL5032807 0.78 SLC5A2 (0.49) ATMSLC5A2SLC5A1EPHX2CD209
SCHEMBL14975385 0.78 SLC5A2 (0.49) ATMSLC5A2SLC5A1EPHX2CD209
SCHEMBL153497 0.78 MAPK8 (0.41) SLC5A2
SCHEMBL153201 0.78 SLC5A2 (0.37) ATMSLC5A2SLC5A1EPHX2

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
EP-1756567-A2 BIOLOGICAL SOIL DETECTOR AND METHOD OF USING SAME 3M Innovative Properties Company (US) 2007-02-28 — — EP claimed
WO-2005114184-A2 BIOLOGICAL SOIL DETECTOR AND METHOD OF USING SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-12-01 — — WO claimed