SCHEMBL13347366

SCHEMBL13347366

C=CCc1cc(CC=C)cc(CC(=O)O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 2/20 0.43
GAA P10253 3/20 0.41
KDM4E B2RXH2 3/20 0.41
MAPT P10636 3/20 0.41
HPGD P15428 3/20 0.41
LMNA P02545 2/20 0.41
TSHR P16473 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
XDH P47989 1/20 0.41
RGS12 O14924 1/20 0.41
POLB P06746 1/20 0.41
NFKB1 P19838 1/20 0.41
APEX1 P27695 1/20 0.41
THPO P40225 1/20 0.41
BLM P54132 1/20 0.41
GNAI1 P63096 1/20 0.41
PMP22 Q01453 1/20 0.41
HIF1A Q16665 1/20 0.41
CA2 P00918 2/20 0.40

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
SCHEMBL3856726 0.84 AKR1B1 (0.52) AKR1B1GAAKDM4EMAPTHPGD
SCHEMBL8984192 0.83 CA2 (0.56) AKR1B1GAAKDM4EMAPTHPGD
SCHEMBL25741028 0.82 AKR1B1 (0.46) AKR1B1GAAKDM4EMAPTHPGD
SCHEMBL583915 0.81 AKR1B1 (0.60) AKR1B1GAAKDM4EMAPTHPGD
SCHEMBL13347362 0.80 PTGDR (0.42) AKR1B1GAAKDM4EMAPTHPGD
SCHEMBL11278615 0.80 PTGDR (0.42) AKR1B1GAAKDM4EMAPTHPGD
Phenylacetic Acid SCHEMBL27901933 0.79 AKR1B1 (0.68) AKR1B1GAALMNATSHRHSD17B10
SCHEMBL19062614 0.79 PTGS1 (0.56) AKR1B1GAAKDM4EMAPTHPGD
SCHEMBL11786434 0.78 XDH (0.41) AKR1B1GAAKDM4EMAPTHPGD
SCHEMBL215399 0.78 XDH (0.50) AKR1B1GAAKDM4EMAPTHPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140155640-A1 Surface Functionalised Nanoparticles NANOCO TECHNOLOGIES LTD. (GB) 2014-06-05 US disclosed
US-8394976-B2 Surface functionalised nanoparticles Nanoco Technologies, Ltd. (GB) 2013-03-12 US disclosed
US-20100113813-A1 SURFACE FUNCTIONALISED NANOPARTICLES NANOCO TECHNOLOGIES LIMITED (GB) 2010-05-06 US disclosed
US-20100068522-A1 Surface Functionalised Nanoparticles NANOCO TECHNOLOGIES LIMITED (GB) 2010-03-18 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 (2 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-20140155640-A1 Surface Functionalised Nanoparticles EPCAM, L1CAM, CD4 AKR1B1 3491/4885GAA 283/4885KDM4E 3228/4885
US-20100113813-A1 SURFACE FUNCTIONALISED NANOPARTICLES CD47, CD63, EPCAM AKR1B1 4466/4885GAA 2306/4885KDM4E 1608/4885

“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.