SCHEMBL5463196

SCHEMBL5463196

COc1cccc2c(C(=O)c3ccccc3)cn(CCCCl)c12

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 14/20 0.62
CNR1 P21554 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.47
KMT2A Q03164 1/20 0.47
MAPT P10636 4/20 0.46
POLB P06746 1/20 0.45
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HSD17B10 Q99714 1/20 0.45
RORC P51449 1/20 0.45
TP53 P04637 1/20 0.44

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
SCHEMBL5332444 0.86 SMN1; SMN2 (0.59) CNR2CNR1SMN1; SMN2KMT2AMAPT
SCHEMBL5451438 0.84 CNR2 (0.70) CNR2SMN1; SMN2KMT2A
SCHEMBL5449584 0.83 CNR2 (0.53) CNR2CNR1SMN1; SMN2MAPTPOLB
SCHEMBL5463245 0.82 CNR2 (0.52) CNR2CNR1TSHR
SCHEMBL15112202 0.82 CNR2 (0.73) CNR2CNR1
SCHEMBL5449416 0.81 MAPT (0.62) CNR2CNR1KMT2AMAPTALDH1A1
SCHEMBL5445308 0.81 KCNA5 (0.51) CNR2CNR1KMT2AKDM4EALDH1A1
SCHEMBL14464358 0.80 CNR2 (0.52) CNR2CNR1KMT2AMAPTPOLB
SCHEMBL5463133 0.80 CNR2 (0.52) CNR2CNR1MAPTKDM4EALDH1A1
SCHEMBL5463316 0.80 CNR2 (0.52) CNR2CNR1SMN1; SMN2MAPTPOLB

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 4 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

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 CNR2 106/4885CNR1 65/4885SMN1; SMN2 1701/4885

“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.