SCHEMBL24943233

SCHEMBL24943233

CCCCCCC(C)(CCCCC)NC

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
THRB P10828 1/20 0.42
EPHX1 P07099 1/20 0.42
GGPS1 O95749 6/20 0.38
LPAR3 Q9UBY5 4/20 0.37
LPAR2 Q9HBW0 1/20 0.37
FDPS P14324 9/20 0.37
CES2 O00748 1/20 0.35
LPAR1 Q92633 1/20 0.35
SMPD1 P17405 1/20 0.35

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
SCHEMBL18430943 1.00 TSHR (0.42) TSHRTHRBEPHX1GGPS1LPAR3
SCHEMBL13181419 1.00 TSHR (0.42) TSHRTHRBEPHX1GGPS1LPAR3
SCHEMBL20413846 1.00 TSHR (0.42) TSHRTHRBEPHX1GGPS1LPAR3
SCHEMBL22624028 1.00 TSHR (0.42) TSHRTHRBEPHX1GGPS1LPAR3
SCHEMBL13181417 0.97 TSHR (0.40) TSHRTHRBEPHX1GGPS1LPAR3
SCHEMBL24533765 0.90 EPHX1 (0.39) TSHRTHRBEPHX1GGPS1LPAR3
SCHEMBL29107041 0.89 TSHR (0.33) TSHRTHRBEPHX1FDPS
SCHEMBL20930917 0.87 EPHX1 (0.35) TSHRTHRBEPHX1GGPS1LPAR3
SCHEMBL19645598 0.84 ALDH1A1 (0.31) TSHREPHX1
SCHEMBL20716197 0.79 TSHR (0.42) TSHRTHRBEPHX1GGPS1LPAR3

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-20230286997-A1 Compounds for the Treatment of Cancer and Inflammatory Disease SHY Therapeutics LLC 2023-09-14 US disclosed
US-11560390-B2 Compounds for the treatment of cancer and inflammatory disease SHY Therapeutics LLC (US) 2023-01-24 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-11560390-B2 Compounds for the treatment of cancer and inflammatory disease MAPK6, MAP3K6, MAPK4 TSHR 4461/4885THRB 1733/4885EPHX1 1313/4885
US-20230286997-A1 Compounds for the Treatment of Cancer and Inflammatory Disease MAPK6, MAP3K6, MAPK4 TSHR 4461/4885THRB 1733/4885EPHX1 1313/4885

“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.