SCHEMBL5456550

SCHEMBL5456550

CC(=O)c1cn(CCCN2CCN(CCOc3ccc(Cl)cc3)CC2)c2c(C#N)cccc12

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ALDH1A1 P00352 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
KCNA5 P22460 6/20 0.43
DRD2 P14416 2/20 0.42
DRD3 P35462 2/20 0.42
HRH2 P25021 1/20 0.41
HRH1 P35367 1/20 0.41
HRH3 Q9Y5N1 4/20 0.40

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
SCHEMBL5448848 0.92 ALDH1A1 (0.53) ALDH1A1L3MBTL1SMN1; SMN2KCNA5
SCHEMBL5332049 0.90 HRH3 (0.42) MEN1KMT2AALDH1A1SMN1; SMN2HRH3
SCHEMBL5453742 0.88 MEN1 (0.49) MEN1KMT2AALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL5446387 0.87 MEN1 (0.48) MEN1KMT2AALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL5442826 0.86 MEN1 (0.47) MEN1KMT2AALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL5447266 0.86 MEN1 (0.50) MEN1KMT2AALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL5446845 0.85 HTR1A (0.43) MEN1KMT2AALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL5448706 0.82 DPP4 (0.40) ALDH1A1HRH3
SCHEMBL5441820 0.82 ALDH1A1 (0.43) ALDH1A1
SCHEMBL5446902 0.82 ALDH1A1 (0.56) MEN1KMT2AALDH1A1L3MBTL1SMN1; SMN2

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-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-09-13 US disclosed
US-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-09-13 US disclosed
US-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-09-13 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-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF GIPR, GHSR, GHRHR MEN1 2039/4885KMT2A 4056/4885ALDH1A1 2963/4885

“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.