SCHEMBL8511583

SCHEMBL8511583

COC(=O)[C@](C)(NC(=O)c1ccccc1)OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
SRC P12931 1/20 0.50
PRSS1 P07477 5/20 0.47
CTSG P08311 5/20 0.47
CTRB1 P17538 5/20 0.47
CMA1 P23946 5/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
CYP2C9 P11712 1/20 0.46
EPHX1 P07099 1/20 0.46
KCNN4 O15554 1/20 0.46
TSHR P16473 1/20 0.46
ELANE P08246 1/20 0.45
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL8511582 1.00 POLB (0.51) POLBSRCPRSS1CTSGCTRB1
SCHEMBL8511586 1.00 POLB (0.51) POLBSRCPRSS1CTSGCTRB1
SCHEMBL10788978 0.88 POLB (0.53) POLBSRCPRSS1CTSGCTRB1
SCHEMBL28128466 0.78 POLB (0.53) POLBSRCPRSS1CTSGCTRB1
SCHEMBL10438916 0.78 POLB (0.50) POLBSRCPRSS1CTSGCTRB1
SCHEMBL9986715 0.77 CES1 (0.51) POLBSRCPRSS1CTSGCTRB1
SCHEMBL7807968 0.76 POLB (0.45) POLBSRCPRSS1CTSGCTRB1
SCHEMBL17284037 0.76 SMN1; SMN2 (0.52) POLBSRCSMN1; SMN2KCNN4RAB9A
SCHEMBL22780388 0.76 POLB (0.69) POLBSRCPRSS1CTSGCTRB1
SCHEMBL14459975 0.76 POLB (0.47) POLBSRCPRSS1CTSGCTRB1

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-5994312-A Peptidyl compounds DARWIN DISCOVERY, LTD. (GB) 1999-11-30 US disclosed