SCHEMBL5332368

SCHEMBL5332368

Cc1cccc(CNC(=O)c2cn(CCCCl)c3ccccc23)c1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
PTPN7 P35236 2/20 0.56
F10 P00742 2/20 0.53
HDAC1 Q13547 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
HPGD P15428 1/20 0.52
HSD17B10 Q99714 1/20 0.52
KLKB1 P03952 1/20 0.50
NR3C1 P04150 1/20 0.49
CNR2 P34972 4/20 0.48
CNR1 P21554 3/20 0.47
ROCK2 O75116 1/20 0.47
ROCK1 Q13464 1/20 0.47
MMP13 P45452 1/20 0.47
ASAH1 Q13510 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
SCHEMBL5341262 0.88 CNR2 (0.59) LMNAPTPN7F10HDAC1HDAC6
SCHEMBL5337000 0.83 PDE10A (0.50) KDM4EALDH1A1HPGDHSD17B10NR3C1
SCHEMBL14411475 0.82 CNR1 (0.51) LMNAPTPN7CNR1
SCHEMBL14411484 0.81 LMNA (0.50) LMNAPTPN7F10HDAC1HDAC6
SCHEMBL5452667 0.81 PDE10A (0.44) PTPN7KDM4EALDH1A1HPGDHSD17B10
SCHEMBL5451107 0.80 CYP2D6 (0.49) LMNAPTPN7F10HDAC1HDAC6
SCHEMBL5463302 0.80 CNR1 (0.48) LMNAPTPN7F10HDAC1HDAC6
SCHEMBL5442965 0.79 BCHE (0.49) LMNAPTPN7F10CNR2CNR1
SCHEMBL5454274 0.78 CNR1 (0.48) LMNAPTPN7F10HDAC1HDAC6
SCHEMBL14410845 0.78 CNR1 (0.48) LMNAPTPN7F10HDAC1HDAC6

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 5 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
WO-2007079239-A2 BICYCLIC NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-07-12 WO disclosed
WO-2007079239-A2 BICYCLIC NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-07-12 WO 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 LMNA 3791/4885PTPN7 592/4885F10 3270/4885

“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.