SCHEMBL4472554

SCHEMBL4472554

Clc1ccccc1-c1ccc(CN2CCN(C3CCCCC3)C(c3ccccc3)C2)cc1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.55
CCR5 P51681 7/20 0.48
GAA P10253 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
CHRNA7 P36544 1/20 0.44
CYP2D6 P10635 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
PDE2A O00408 1/20 0.42

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
SCHEMBL4474465 0.88 CNR2 (0.60) CNR2CCR5GAALMNAPOLB
SCHEMBL4474625 0.85 CNR2 (0.66) CNR2CCR5GAALMNAPOLB
SCHEMBL4480801 0.81 CNR2 (0.52) CNR2CCR5CHRNA7CYP2D6PDE2A
SCHEMBL4465986 0.81 CNR2 (0.61) CNR2CHRNA7CYP2D6KMT2APDE2A
SCHEMBL4476194 0.79 CNR2 (0.58) CNR2CHRNA7CYP2D6PDE2A
SCHEMBL4471272 0.78 CNR2 (0.71) CNR2CYP2D6MEN1KMT2APDE2A
SCHEMBL4476472 0.78 CNR2 (0.57) CNR2GAALMNAPOLBCHRNA7
SCHEMBL13708759 0.78 CNR2 (0.70) CNR2CCR5MEN1KMT2APDE2A
SCHEMBL4484413 0.76 CNR2 (0.55) CNR2CHRNA7PDE2A
SCHEMBL4751823 0.76 CNR2 (0.55) CNR2CCR5CHRNA7CYP2D6PDE2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7595397-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-09-29 US disclosed
US-7595397-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-09-29 US disclosed
US-7595397-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-09-29 US disclosed
US-20070191340-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-08-16 US disclosed
US-20070191340-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-08-16 US disclosed
US-20070191340-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-08-16 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-20070191340-A1 Compounds Which Modulate The CB2 Receptor CNR1, CNR2, ARRB1 CNR2 2/4885CCR5 479/4885GAA 4732/4885

“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.