SCHEMBL10965615

SCHEMBL10965615

O=C(O)C=CC(=CCCCO)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
TP53 P04637 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
EGLN3 Q9H6Z9 1/20 0.38
HCAR2 Q8TDS4 5/20 0.33
EP300 Q09472 1/20 0.31
CAMK2A Q9UQM7 1/20 0.31

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
SCHEMBL9700716 0.87 TSHR (0.41) TSHRTP53EGLN1EGLN3HCAR2
SCHEMBL1900808 0.82 HCAR2 (0.48) TSHRTP53EGLN1EGLN3HCAR2
SCHEMBL5169539 0.74 KDM1A (0.40) HCAR2EP300
Fumaric Acid SCHEMBL8945173 0.74 TSHR (0.60) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL30440900 0.74 TSHR (0.60) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL9247152 0.74 TSHR (0.60) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL30441048 0.74 TSHR (0.60) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL9247161 0.74 TSHR (0.60) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL3953013 0.74 TSHR (0.60) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL28615983 0.74 TSHR (0.60) TSHRTP53EGLN1EGLN3HCAR2

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-4534866-A ADDING A REACTION PRODUCT OF ACRYLIC ACID, HYDROXYLATED LOWER ALKYL ACRYLATE, AND HYPOPHOSPHOROUS ACID BETZ LABORATORIES, INC. (US) 1985-08-13 US disclosed