SCHEMBL10409185

SCHEMBL10409185

C=CC(=O)OC(O)CCC.C=CCOCCO

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.39
HPGD P15428 1/20 0.36
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 2/20 0.32
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 0.32
HSD17B10 Q99714 1/20 0.32
THRB P10828 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
Allyl Alcohol SCHEMBL9853356 0.83 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL26503 0.83 TSHR (0.44) TSHRHPGDTDP1ALDH1A1TP53
SCHEMBL27143080 0.81 TSHR (0.42) TSHRHPGDTDP1ALDH1A1TP53
SCHEMBL9333567 0.80 TSHR (0.54) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL27610733 0.80 TSHR (0.47) TSHRHPGDMEN1KMT2AALDH1A1
SCHEMBL9333707 0.78 TSHR (0.40) TSHRHPGDTDP1ALDH1A1TP53
SCHEMBL2283957 0.77 TSHR (0.40) TSHRHPGDALDH1A1TP53HIF1A
Phosphoric Acid SCHEMBL28457487 0.77 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28260366 0.77 TSHR (0.36) TSHRHPGDTDP1MEN1POLB
SCHEMBL3401710 0.75 TSHR (0.38) TSHRHPGDTDP1ALDH1A1TP53

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-4963617-A CONTAINING GLYCIDYL (METH)ACRYLATE SOCIETE CHIMIQUE DES CHARBONNAGES S.A. (FR) 1990-10-16 US claimed
US-4963617-A CONTAINING GLYCIDYL (METH)ACRYLATE SOCIETE CHIMIQUE DES CHARBONNAGES S.A. (FR) 1990-10-16 US disclosed