SCHEMBL14259641

SCHEMBL14259641

COc1ccc(/C=C/C(=O)OC(C(=O)O)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C(=O)O)cc1O

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.80
HSD17B10 Q99714 3/20 0.80
TP53 P04637 1/20 0.80
ALOX15 P16050 1/20 0.80
SRC P12931 2/20 0.69
MMP1 P03956 2/20 0.64
MMP9 P14780 1/20 0.63
EPHX2 P34913 3/20 0.60
APP P05067 4/20 0.58
TTR P02766 3/20 0.58
MAPT P10636 4/20 0.56
PTPN1 P18031 1/20 0.56
SYNJ2 O15056 1/20 0.55
KDM4E B2RXH2 3/20 0.55
POLB P06746 2/20 0.55
GAA P10253 2/20 0.55
HPGD P15428 2/20 0.55
RECQL P46063 2/20 0.55
CYP1A2 P05177 1/20 0.55
KDM1A O60341 1/20 0.55

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
SCHEMBL14259643 0.94 HSD17B10 (0.71) TDP1HSD17B10TP53ALOX15SRC
SCHEMBL7627853 0.93 HSD17B10 (0.80) TDP1HSD17B10TP53ALOX15SRC
Chicoric Acid SCHEMBL961606 0.89 HSD17B10 (1.00) TDP1HSD17B10TP53ALOX15SRC
Cichoric Acid SCHEMBL29385936 0.89 HSD17B10 (1.00) TDP1HSD17B10TP53ALOX15SRC
Chicoric Acid SCHEMBL30518333 0.89 HSD17B10 (1.00) TDP1HSD17B10TP53ALOX15SRC
Chicoric Acid SCHEMBL963407 0.89 HSD17B10 (1.00) TDP1HSD17B10TP53ALOX15SRC
Chicoric Acid SCHEMBL30995918 0.89 HSD17B10 (1.00) TDP1HSD17B10TP53ALOX15SRC
Chicoric Acid SCHEMBL730803 0.89 HSD17B10 (1.00) TDP1HSD17B10TP53ALOX15SRC
Chicoric Acid SCHEMBL21176639 0.89 HSD17B10 (1.00) TDP1HSD17B10TP53ALOX15SRC
Cichoric Acid SCHEMBL29349701 0.89 HSD17B10 (1.00) TDP1HSD17B10TP53ALOX15SRC

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-20080076738-A1 Phosphonate Analogs Of Hiv Integrase Inhibitor Compounds GILEAD SCIENCES, INC. 2008-03-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080076738-A1 Phosphonate Analogs Of Hiv Integrase Inhibitor Compounds TYMP, PNP, PIKFYVE TDP1 135/4885HSD17B10 1111/4885TP53 1308/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.