SCHEMBL4879666

SCHEMBL4879666

CCCCOP(O)O.CCCCOP(O)OCCCC.OP(O)O

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
ALDH1A1 P00352 1/20 0.34
ATM Q13315 1/20 0.32
CYP3A4 P08684 1/20 0.31
HPGD P15428 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
SCHEMBL10667835 0.93 TSHR (0.40) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL29053127 0.91 THRB (0.39) TSHRHPGD
SCHEMBL337285 0.90
SCHEMBL108259 0.90 TSHR (0.42) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL7081314 0.87
SCHEMBL2363637 0.87 TSHR (0.40) TSHRADRB2ADRB1ADRB3ALDH1A1
Hydrochloric Acid SCHEMBL11312583 0.87 TSHR (0.40) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL503897 0.87
SCHEMBL9116650 0.87 TSHR (0.40) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL28873670 0.87 TSHR (0.40) TSHRADRB2ADRB1ADRB3ALDH1A1

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-20080103046-A1 Process for making a plant growth regulator PALMER FRANCINE 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-20080103046-A1 Process for making a plant growth regulator GRHPR, PPIP5K2, PPP6R1 TSHR 908/4885ADRB2 4638/4885ADRB1 4569/4885

“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.