SCHEMBL8639682

SCHEMBL8639682

CCCCC=C(C)C(=O)O.[KH]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.52
GRIK1 P39086 1/20 0.46
F7 P08709 2/20 0.41
F3 P13726 2/20 0.41
TSHR P16473 1/20 0.39
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
CD81 P60033 1/20 0.38
TERT O14746 3/20 0.36
MAPT P10636 2/20 0.36
BLM P54132 2/20 0.36
HSD17B10 Q99714 2/20 0.36
FABP4 P15090 2/20 0.36
GMNN O75496 1/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
CYP2C9 P11712 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL8639675 1.00 EP300 (0.52) EP300GRIK1F7F3TSHR
SCHEMBL6910247 0.98 EP300 (0.54) EP300GRIK1F7F3TSHR
SCHEMBL22544 0.98 EP300 (0.54) EP300GRIK1F7F3TSHR
SCHEMBL6910252 0.98 EP300 (0.54) EP300GRIK1F7F3TSHR
SCHEMBL2406221 0.98 EP300 (0.54) EP300GRIK1F7F3TSHR
SCHEMBL22546 0.98 EP300 (0.54) EP300GRIK1F7F3TSHR
Acetic Acid SCHEMBL8865364 0.95 EP300 (0.52) EP300GRIK1F7F3TSHR
Hydrochloric Acid SCHEMBL9222950 0.95 EP300 (0.52) EP300GRIK1F7F3TSHR
Acetic Acid SCHEMBL8865359 0.95 EP300 (0.52) EP300GRIK1F7F3TSHR
Water SCHEMBL5245383 0.95 EP300 (0.52) EP300GRIK1F7F3TSHR

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-5750735-A CHEMICAL INTERMEDIATES FOR ANTIBIOTICS AMERICAN CYANAMID COMPANY (US) 1998-05-12 US disclosed
US-5744465-A Method of inhibiting a β-lactamase enzyme by administering novel 2-thiosubstituted carbapenems AMERICAN CYANAMID COMPANY (US) 1998-04-28 US disclosed