SCHEMBL5453696

SCHEMBL5453696

COCCN1CCN(CCCn2cc(C(C)=O)c3ccccc32)CC1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.62
ALDH1A1 P00352 1/20 0.62
KMT2A Q03164 1/20 0.61
TSHR P16473 1/20 0.56
CNR2 P34972 7/20 0.56
CNR1 P21554 4/20 0.56
CREBBP Q92793 2/20 0.55
NPSR1 Q6W5P4 1/20 0.55
NR2F2 P24468 1/20 0.54
PKM P14618 1/20 0.54
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50

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
SCHEMBL5456168 0.91 L3MBTL1 (0.61) SMN1; SMN2TSHRCNR2CNR1NPSR1
SCHEMBL5451254 0.90 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1KMT2ATSHRCNR2
SCHEMBL5418358 0.87 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1KMT2ACNR2CNR1
SCHEMBL5456434 0.86 CNR2 (0.51) SMN1; SMN2ALDH1A1KMT2ATSHRCNR2
SCHEMBL5450086 0.85 CNR2 (0.62) SMN1; SMN2ALDH1A1KMT2ACNR2CNR1
SCHEMBL5448708 0.84 SMN1; SMN2 (0.55) SMN1; SMN2ALDH1A1KMT2ATSHRCNR2
SCHEMBL5454706 0.84 DRD3 (0.60) SMN1; SMN2ALDH1A1KMT2ACNR2CNR1
SCHEMBL5454647 0.83 CNR2 (0.74) SMN1; SMN2ALDH1A1CNR2CNR1CREBBP
SCHEMBL14463824 0.82 CNR2 (0.57) SMN1; SMN2ALDH1A1KMT2ACNR2CNR1
SCHEMBL5448205 0.82 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1KMT2ACNR2CNR1

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 SMN1; SMN2 1701/4885ALDH1A1 2963/4885KMT2A 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.