SCHEMBL5836124

SCHEMBL5836124

CN(C(=O)OC(C)(C)C)C1(C(=O)O)CCc2ccccc2C1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 2/20 0.41
BACE1 P56817 2/20 0.35
FABP4 P15090 1/20 0.34
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
KDM1A O60341 1/20 0.33
ATM Q13315 1/20 0.33
PAX8 Q06710 1/20 0.33
OPRM1 P35372 1/20 0.32
OPRL1 P41146 1/20 0.32
MT-CO2 P00403 1/20 0.32
KCNH2 Q12809 1/20 0.32
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL15218847 0.88 GHSR (0.41) GHSRBACE1BRD4CREBBPOPRM1
SCHEMBL5835223 0.78 GHSR (0.66) GHSRKCNH2
SCHEMBL5835049 0.77 GHSR (0.46) GHSRBACE1ATMOPRM1OPRL1
SCHEMBL2745088 0.76 MT-CO2 (0.33) FABP4BRD4CREBBPMT-CO2
SCHEMBL1771222 0.75 FABP4 (0.35) FABP4
SCHEMBL5835084 0.73 GHSR (0.41) GHSRBACE1KDM1A
SCHEMBL25178779 0.73 CTSD (0.31) FABP4
SCHEMBL1770349 0.73 CTSD (0.31) FABP4
SCHEMBL753247 0.72 HDAC9 (0.42) FABP4OPRM1OPRL1
SCHEMBL4397311 0.71 CTSD (0.30) FABP4

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-7115767-B2 Tetraline derivatives as ghrelin receptor modulators ABBOTT LABORATORIES (US) 2006-10-03 US disclosed
US-20050014794-A1 Tetraline derivatives as ghrelin receptor modulators ABBVIE INC. 2005-01-20 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-20050014794-A1 Tetraline derivatives as ghrelin receptor modulators GPR119, GHSR, GIPR GHSR 2/4885BACE1 3239/4885FABP4 134/4885

“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.