SCHEMBL2063633

SCHEMBL2063633

CNCCn1cc(-c2ccc(F)c(Cl)c2)nc1C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RPS6KB1 P23443 17/20 0.51
AKT1 P31749 16/20 0.51
MAPT P10636 1/20 0.47
CNR1 P21554 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
GPR35 Q9HC97 1/20 0.47
GPR55 Q9Y2T6 1/20 0.47
TRPV3 Q8NET8 1/20 0.43

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
SCHEMBL11904466 0.93 RPS6KB1 (0.52) RPS6KB1AKT1MAPTCNR1NPSR1
SCHEMBL2063679 0.92 RPS6KB1 (0.51) RPS6KB1AKT1MAPTCNR1NPSR1
SCHEMBL2063243 0.91 RPS6KB1 (0.49) RPS6KB1AKT1MAPTCNR1NPSR1
SCHEMBL11904316 0.90 RPS6KB1 (0.53) RPS6KB1AKT1MAPTCNR1NPSR1
SCHEMBL11904621 0.89 RPS6KB1 (0.63) RPS6KB1AKT1
SCHEMBL2062977 0.89 RPS6KB1 (0.51) RPS6KB1AKT1
SCHEMBL11904260 0.89 RPS6KB1 (0.60) RPS6KB1AKT1
SCHEMBL2064139 0.86 RPS6KB1 (0.46) RPS6KB1AKT1MAPTCNR1NPSR1
SCHEMBL2064061 0.86 GPR119 (0.44) RPS6KB1AKT1MAPTCNR1NPSR1
SCHEMBL2064656 0.86 GPR119 (0.47) RPS6KB1AKT1MAPTCNR1NPSR1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102216302-B Akt and p70 s6 kinase inhibitors LILLY CO ELI 2013-08-21 CN disclosed
EP-2358710-B1 AKT AND P70 S6 KINASE INHIBITORS LILLY CO ELI (US) 2012-08-15 EP disclosed
US-8148387-B2 AKT and P70 S6 kinase inhibitors ELI LILLY AND COMPANY (US) 2012-04-03 US disclosed
CN-102216302-A Akt and p70 s6 kinase inhibitors LILLY CO ELI 2011-10-12 CN disclosed
US-20100120801-A1 AKT AND P70 S6 KINASE INHIBITORS ELI LILLY AND COMPANY 2010-05-13 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-20100120801-A1 AKT AND P70 S6 KINASE INHIBITORS RPS6KA6, RPS6KA1, MTOR RPS6KB1 7/4885AKT1 17/4885MAPT 1931/4885

“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.