SCHEMBL7216378

SCHEMBL7216378

CC(C)(C)[Si](C)(C)OCc1ccc(-c2cccnn2)cc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 9/20 0.33
HDAC4 P56524 2/20 0.33
DHODH Q02127 1/20 0.33
EP300 Q09472 2/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
F2 P00734 1/20 0.31
IDO1 P14902 1/20 0.30
AGXT P21549 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
SCHEMBL6212657 0.75 EP300 (0.35) WNT3AHDAC4DHODHEP300PRMT5
SCHEMBL6212659 0.75 EP300 (0.35) WNT3AHDAC4DHODHEP300PRMT5
SCHEMBL13478010 0.75 WNT3A (0.40) WNT3AHDAC4DHODHEP300F2
SCHEMBL28129052 0.74 DUT (0.33)
SCHEMBL7216290 0.74 WNT3A (0.36) WNT3AIDO1AGXT
SCHEMBL13637169 0.73 RAB9A (0.44) WNT3AHDAC4DHODHPRMT5WDR77
SCHEMBL17440111 0.72 NAAA (0.42) HDAC4
SCHEMBL1315036 0.72 IDO1 (0.46) IDO1AGXT
SCHEMBL5221804 0.72 IDO1 (0.35) IDO1AGXT
SCHEMBL12002628 0.72 IDO1 (0.46) IDO1AGXT

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
US-6599918-B2 Inhibit Factor Xa Factor IIa (thrombin) AVENTIS PHARMACEUTICALS INC. 2003-07-29 US disclosed