SCHEMBL13060339

SCHEMBL13060339

Cc1c(C(=O)O)ccc2c1OC(I)CO2

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
HPGD P15428 3/20 0.36
KDM4E B2RXH2 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HTT P42858 2/20 0.36
MAPK1 P28482 1/20 0.35
NPC1 O15118 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
TP53 P04637 1/20 0.33
RAB9A P51151 1/20 0.33
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.31
POLB P06746 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL8595403 0.80 PRKAB2 (0.43) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL3761317 0.80 PRKAB2 (0.43) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL13060338 0.77 TSHR (0.43) ALDH1A1HPGDKDM4ENPC1SMN1; SMN2
SCHEMBL14095931 0.77 TSHR (0.43) ALDH1A1HPGDKDM4ENPC1SMN1; SMN2
SCHEMBL2427291 0.74 ALDH1A1 (0.44) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL2427488 0.74 KDM4E (0.55) ALDH1A1HPGDKDM4EHSD17B10HTT
Hydrochloric Acid SCHEMBL6182013 0.73 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL21496548 0.73 MAPK1 (0.36) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL3777567 0.72 KDM4E (0.30) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL6182009 0.72 MAPK1 (0.35) ALDH1A1HPGDKDM4EHSD17B10HTT

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-7851220-B2 Reduced level of background gene expression; responds to submicromolar concentrations of nonsteroidal ligand INTREXON CORPORATION (US) 2010-12-14 US disclosed
US-20080103113-A1 Reduced level of background gene expression; responds to submicromolar concentrations of nonsteroidal ligand HORMANN ROBERT E 2008-05-01 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-20080103113-A1 Reduced level of background gene expression; responds to submicromolar concentrations of nonsteroidal ligand NR5A1, NR0B2, NR0B1 ALDH1A1 4095/4885HPGD 827/4885KDM4E 3645/4885

“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.