SCHEMBL5835552

SCHEMBL5835552

CCCCN(CCCC)c1ccc(NC(=O)[C@]2(N(CC(C)C)C(=O)O)CCc3ccccc3C2)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 5/20 0.48
KCNH2 Q12809 1/20 0.43
CNR2 P34972 1/20 0.38
ALDH1A1 P00352 1/20 0.37
ADRB2 P07550 1/20 0.37
NAMPT P43490 3/20 0.36
POLB P06746 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
NPSR1 Q6W5P4 2/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
NOX1 Q9Y5S8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL5835357 1.00 GHSR (0.48) GHSRKCNH2CNR2ALDH1A1ADRB2
SCHEMBL5835255 0.79 GHSR (0.52) GHSRKCNH2CNR2ALDH1A1POLB
SCHEMBL5836115 0.79 GHSR (0.52) GHSRKCNH2CNR2ALDH1A1POLB
SCHEMBL5835504 0.79 GHSR (0.52) GHSRKCNH2CNR2ALDH1A1POLB
SCHEMBL5835637 0.79 GHSR (0.52) GHSRKCNH2CNR2ALDH1A1POLB
SCHEMBL5835479 0.79 GHSR (0.45) GHSRKCNH2ALDH1A1POLBHDAC6
SCHEMBL5835384 0.79 GHSR (0.45) GHSRKCNH2ALDH1A1POLBHDAC6
SCHEMBL5836507 0.79 GHSR (0.61) GHSRKCNH2KMT2AMEN1NPC1
SCHEMBL5835630 0.79 GHSR (0.61) GHSRKCNH2KMT2AMEN1NPC1
SCHEMBL5835248 0.78 GHSR (0.49) GHSRKCNH2ALDH1A1NAMPTPOLB

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 4 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 claimed
US-20050014794-A1 Tetraline derivatives as ghrelin receptor modulators ABBVIE INC. 2005-01-20 US claimed
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 2/4885KCNH2 3931/4885CNR2 666/4885

“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.