SCHEMBL5963352

SCHEMBL5963352

CCNCC1=C(c2cccc(C(F)(F)F)c2)C(=O)NC12CCCCC2

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SLC6A4 P31645 3/20 0.38
SLC6A3 Q01959 2/20 0.38
HTT P42858 1/20 0.37
AR P10275 1/20 0.37
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
SLC6A2 P23975 1/20 0.36
PDE7A Q13946 1/20 0.36
RXRA P19793 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
SCHEMBL5963769 0.84 PDE7B (0.39) SLC6A4SLC6A3TP53SLC6A2PDE7A
SCHEMBL5964235 0.84 SMN1; SMN2 (0.48) SMN1; SMN2MEN1KMT2ASLC6A4SLC6A3
SCHEMBL5963932 0.83 KMT2A (0.40) KMT2APOLBPDE7A
SCHEMBL5963733 0.81 PDE7A (0.41) KMT2ASLC6A4SLC6A3POLBSLC6A2
SCHEMBL5963527 0.79 ALDH1A1 (0.42) SMN1; SMN2MEN1KMT2ASLC6A4SLC6A3
SCHEMBL5963585 0.79 POLB (0.42) MEN1KMT2AHTTPOLB
SCHEMBL5963924 0.78 SMN1; SMN2 (0.39) SMN1; SMN2MEN1KMT2ASLC6A4SLC6A3
SCHEMBL5964630 0.78 SMN1; SMN2 (0.41) SMN1; SMN2MEN1KMT2ASLC6A4SLC6A3
SCHEMBL5963591 0.78 SLC6A4 (0.43) KMT2ASLC6A4SLC6A3SLC6A2PDE7A
SCHEMBL5963658 0.77 AKR1B1 (0.40) KMT2APDE7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7125840-B2 Substituted dipeptides as growth hormone secretagogues ELI LILLY AND COMPANY (US) 2006-10-24 US disclosed
EP-1326851-B1 SUBSTITUTED DIPEPTIDES AS GROWTH HORMONE SECRETAGOGUES LILLY CO ELI (US) 2004-06-30 EP disclosed
US-20040058971-A1 Substituted dipeptides as growth hormone secretagogues ELI LILLY AND COMPANY 2004-03-25 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-20040058971-A1 Substituted dipeptides as growth hormone secretagogues GHSR, GHRHR, SSTR4 SMN1; SMN2 3213/4885MEN1 136/4885KMT2A 3557/4885

“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.