SCHEMBL5337905

SCHEMBL5337905

Fc1ccccc1-c1c2c(nn1-c1ccc(Cl)cc1)CN(C1CCCCC1)C2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.43
CNR2 P34972 2/20 0.36
ADORA3 P0DMS8 2/20 0.35
ADORA1 P30542 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRA2 P47869 1/20 0.34
PIK3CD O00329 1/20 0.34
PIK3R2 O00459 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34
PIK3R5 Q8WYR1 1/20 0.34
PIK3R3 Q92569 1/20 0.34
NR1H4 Q96RI1 1/20 0.34
ACKR3 P25106 1/20 0.33
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
CYP1A2 P05177 1/20 0.33
HIF1A Q16665 1/20 0.33

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
SCHEMBL5337908 0.79 PIK3CD (0.38) GABRA1GABRA2PIK3CDPIK3R2PIK3CA
SCHEMBL5341646 0.78 CNR1 (0.48) CNR1ADORA3ADORA1IDO1TDO2
SCHEMBL5343755 0.77 CNR1 (0.48) CNR1ADORA3ADORA1IDO1TDO2
SCHEMBL5338137 0.68 CNR1 (0.51) CNR1CNR2
SCHEMBL5341653 0.67 CYP1A2 (0.41) IDO1TDO2CYP1A2HIF1APTGS1
SCHEMBL5344761 0.67 CNR1 (0.56) CNR1CNR2ADORA3ADORA1IDO1
SCHEMBL5340635 0.66 CNR1 (0.55) CNR1CNR2ADORA3ADORA1IDO1
SCHEMBL29042749 0.60 MAPT (0.44) ADORA3GABRA1GABRA2CYP1A2
SCHEMBL2780491 0.58 KMT2A (0.65) CNR1CNR2HRH3
SCHEMBL22848099 0.58 KMT2A (0.65) CNR1CNR2HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7230024-B2 Cannabinoid receptor ligands and uses thereof PFIZER INC (US) 2007-06-12 US claimed
US-20060205948-A1 Cannabinoid receptor ligands and uses thereof PFIZER INC 2006-09-14 US claimed
US-20040214855-A1 Cannabinoid receptor ligands and uses thereof PFIZER INC 2004-10-28 US claimed
US-7241788-B2 Cannabinoid receptor ligands and uses thereof PFIZER INC. (US) 2007-07-10 US disclosed
US-7230024-B2 Cannabinoid receptor ligands and uses thereof PFIZER INC (US) 2007-06-12 US disclosed
US-7145012-B2 Cannabinoid receptor ligands and uses thereof PFIZER INC. (US) 2006-12-05 US disclosed
US-20060205948-A1 Cannabinoid receptor ligands and uses thereof PFIZER INC 2006-09-14 US disclosed
US-20060205720-A1 Cannabinoid receptor ligands and uses thereof PFIZER INC 2006-09-14 US disclosed
EP-1622909-A1 CANNABINOID RECEPTOR LIGANDS AND USES THEREOF Pfizer Products Inc. (US) 2006-02-08 EP disclosed
WO-2004094429-A1 CANNABINOID RECEPTOR LIGANDS AND USES THEREOF PFIZER PRODUCTS INC. (US) 2004-11-04 WO disclosed
US-20040214855-A1 Cannabinoid receptor ligands and uses thereof PFIZER INC 2004-10-28 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 (3 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-20060205720-A1 Cannabinoid receptor ligands and uses thereof CNR2, CNR1, GPR18 CNR1 2/4885CNR2 1/4885ADORA3 437/4885
US-20060205948-A1 Cannabinoid receptor ligands and uses thereof CNR2, CNR1, GPR18 CNR1 2/4885CNR2 1/4885ADORA3 437/4885
US-20040214855-A1 Cannabinoid receptor ligands and uses thereof CNR1, CNR2, GPR18 CNR1 1/4885CNR2 2/4885ADORA3 496/4885

“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.