SCHEMBL3262837

SCHEMBL3262837

O=C(CO)C(O)CO.O=C(CO)[C@H](O)CO

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 1/20 0.53
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.33
AKR1B1 P15121 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PDE4A P27815 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL439347 1.00
SCHEMBL59986 1.00
SCHEMBL16234794 1.00 OR51E2 (0.53) OR51E2CYP2C9TSHRLMNAALDH1A1
SCHEMBL15478 1.00
Water SCHEMBL4388261 0.97
Water SCHEMBL9238992 0.97
Water SCHEMBL9238988 0.97
Phosphoric Acid SCHEMBL19583580 0.89 OR51E2 (0.43) OR51E2CYP2C9TSHR
SCHEMBL7950628 0.87 OR51E2 (0.42) OR51E2CYP2C9TSHRTDP1
SCHEMBL8440554 0.79 OR51E2 (0.36) OR51E2CYP2C9TSHRAKR1B1PDE4A

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-20100034760-A1 Method of Increasing the Tanning Effect of Self-tanning Substances MERCK PATENT GMBH (DE) 2010-02-11 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-20100034760-A1 Method of Increasing the Tanning Effect of Self-tanning Substances TYR, TES, SHBG OR51E2 2737/4885CYP2C9 2382/4885TSHR 2430/4885

“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.