SCHEMBL5451082

SCHEMBL5451082

CCOC(=O)C1CCN(CCCn2cc(C(=O)CC)c3ccccc32)CC1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.60
POLB P06746 1/20 0.60
KMT2A Q03164 4/20 0.59
MEN1 O00255 2/20 0.51
CNR2 P34972 2/20 0.50
ALDH1A1 P00352 4/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
CNR1 P21554 3/20 0.49
CREBBP Q92793 1/20 0.49
ALOX15 P16050 1/20 0.48
MAPT P10636 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
KDM4E B2RXH2 1/20 0.47
GLA P06280 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL5446709 0.87 KMT2A (0.56) MAPK1POLBKMT2AMEN1CNR2
SCHEMBL5452863 0.85 KCNH2 (0.57) KMT2ACNR2ALDH1A1CNR1MAPT
SCHEMBL5460467 0.85 CREBBP (0.64) MAPK1POLBKMT2AMEN1CNR2
SCHEMBL5450012 0.82 CNR1 (0.56) KMT2ACNR2CNR1L3MBTL1
SCHEMBL14411153 0.81 KMT2A (0.50) POLBKMT2AMEN1CNR2ALDH1A1
SCHEMBL5452082 0.81 L3MBTL1 (0.57) KMT2ACNR2CNR1L3MBTL1
SCHEMBL5453370 0.80 KMT2A (0.58) KMT2AMEN1CNR2ALDH1A1SMN1; SMN2
SCHEMBL5463074 0.79 CNR2 (0.52) KMT2AMEN1CNR2ALDH1A1CNR1
SCHEMBL5452512 0.76 CNR2 (0.51) POLBKMT2AMEN1CNR2CNR1
SCHEMBL2033917 0.75 CYP19A1 (0.57) KMT2ACNR2CNR1CREBBP

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 MAPK1 1443/4885POLB 4520/4885KMT2A 4056/4885

“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.