SCHEMBL5337908

SCHEMBL5337908

Fc1ccccc1-c1c2c(nn1-c1ccc(Cl)cc1)CN(c1ccccc1)C2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.38
PIK3R2 O00459 2/20 0.38
PIK3CA P42336 2/20 0.38
PIK3CB P42338 2/20 0.38
PIK3CG P48736 2/20 0.38
PIK3R5 Q8WYR1 2/20 0.38
PIK3R3 Q92569 2/20 0.38
CYP1A2 P05177 1/20 0.38
HIF1A Q16665 1/20 0.38
KMT2A Q03164 3/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
MAPT P10636 3/20 0.36
PTGS1 P23219 3/20 0.35
PTGS2 P35354 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
HTT P42858 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRA2 P47869 1/20 0.34

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
SCHEMBL5337905 0.79 CNR1 (0.43) PIK3CDPIK3R2PIK3CAPIK3CBPIK3CG
SCHEMBL5341653 0.76 CYP1A2 (0.41) CYP1A2HIF1AKMT2APTGS1PTGS2
SCHEMBL29042749 0.69 MAPT (0.44) CYP1A2KMT2AMAPTSMN1; SMN2GABRA1
SCHEMBL5343755 0.68 CNR1 (0.48) CYP1A2HIF1AIDO1TDO2LMNA
SCHEMBL5341646 0.68 CNR1 (0.48) IDO1TDO2LMNA
SCHEMBL5344766 0.64 CNR1 (0.44) CYP1A2HIF1AKMT2APTGS1PTGS2
SCHEMBL8132350 0.63 PTGS2 (0.59) KMT2AHTR2AHTR2CHTR2BPTGS1
SCHEMBL28691202 0.63 PTGS2 (0.59) KMT2AHTR2AHTR2CHTR2BPTGS1
SCHEMBL1475759 0.63 HTR2A (0.82) HTR2AHTR2CHTR2BPTGS1PTGS2
SCHEMBL1475799 0.63 HTR2A (0.82) HTR2AHTR2CHTR2BPTGS1PTGS2

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 PIK3CD 1617/4885PIK3R2 782/4885PIK3CA 2210/4885
US-20060205948-A1 Cannabinoid receptor ligands and uses thereof CNR2, CNR1, GPR18 PIK3CD 1617/4885PIK3R2 782/4885PIK3CA 2210/4885
US-20040214855-A1 Cannabinoid receptor ligands and uses thereof CNR1, CNR2, GPR18 PIK3CD 1593/4885PIK3R2 838/4885PIK3CA 2120/4885

“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.