SCHEMBL9314607

SCHEMBL9314607

C=CCOC(=O)NCC(CO)C(C)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
ADRB3 P13945 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
SCHEMBL9313404 0.94 TDP1 (0.32) CASP1TDP1ADRB2ADRB1ADRB3
SCHEMBL9314639 0.89
SCHEMBL9313381 0.84
SCHEMBL9314278 0.84
SCHEMBL9313418 0.78 TDP1 (0.32) TDP1
SCHEMBL9696715 0.74 TDP1 (0.31) TDP1
SCHEMBL9314518 0.73 TDP1 (0.33) TDP1
SCHEMBL16689248 0.73 TDP1 (0.36) TDP1
SCHEMBL9313394 0.73 TDP1 (0.38) CASP1TDP1ADRB2ADRB1ADRB3
SCHEMBL9314610 0.72

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-5286721-A Antimicrobial agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-02-15 US disclosed
WO-1992006978-A1 1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-04-30 WO disclosed