SCHEMBL2809566

SCHEMBL2809566

CC(C)(C)OC(=O)N1CCN(C(=O)O)CC1c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 5/20 0.57
NR1H3 Q13133 4/20 0.57
ABHD6 Q9BV23 1/20 0.51
ROCK2 O75116 1/20 0.50
RIPK1 Q13546 3/20 0.46
RORC P51449 2/20 0.46
GPR119 Q8TDV5 1/20 0.45
P2RX7 Q99572 1/20 0.44
HDAC6 Q9UBN7 2/20 0.44
POLB P06746 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
DTYMK P23919 1/20 0.42

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
SCHEMBL4712983 0.93 NR1H2 (0.58) NR1H2NR1H3ABHD6ROCK2RIPK1
SCHEMBL12988184 0.89 NR1H2 (0.57) NR1H2NR1H3ABHD6ROCK2RORC
SCHEMBL83392 0.89 MEN1 (0.48) NR1H2NR1H3ABHD6ROCK2P2RX7
SCHEMBL82172 0.89 NR1H2 (0.57) NR1H2NR1H3ABHD6ROCK2RORC
SCHEMBL521802 0.89 NR1H2 (0.47) NR1H2NR1H3ABHD6ROCK2RORC
SCHEMBL38661096 0.89 NR1H2 (0.47) NR1H2NR1H3ABHD6ROCK2RIPK1
SCHEMBL522583 0.87 NR1H2 (0.53) NR1H2NR1H3ABHD6ROCK2GPR119
SCHEMBL38662977 0.87 GPR119 (0.47) NR1H2NR1H3ABHD6ROCK2RIPK1
SCHEMBL12989104 0.87 NR1H2 (0.45) NR1H2NR1H3ABHD6ROCK2RORC
SCHEMBL12989117 0.87 NR1H2 (0.45) NR1H2NR1H3ABHD6ROCK2RORC

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-20100240638-A1 Organic Compounds and their uses NOVARTIS AG (CH) 2010-09-23 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-20100240638-A1 Organic Compounds and their uses OAT, HAVCR2, CYP3A43 NR1H2 381/4885NR1H3 275/4885ABHD6 3334/4885

“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.