SCHEMBL5519435

SCHEMBL5519435

N#Cc1ccc(-c2ncc(N3CCS(=O)(=O)CC3)nc2Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 3/20 0.49
▸ CNR1 P21554 2/20 0.48
▸ CNR2 P34972 1/20 0.48
▸ HRH4 Q9H3N8 3/20 0.38
▸ HRH3 Q9Y5N1 2/20 0.37
▸ HTR1A P08908 1/20 0.37
▸ ADRA2A P08913 1/20 0.37
▸ ADRA2C P18825 1/20 0.37
▸ HTR1D P28221 1/20 0.37
▸ HTR2A P28223 1/20 0.37
▸ HTR2C P28335 1/20 0.37
▸ HTR7 P34969 1/20 0.37
▸ KDM1A O60341 3/20 0.37
▸ CHEK1 O14757 1/20 0.36
▸ EGLN2 Q96KS0 1/20 0.36
▸ MET P08581 1/20 0.36
▸ FAAH O00519 1/20 0.35
▸ CKS1B P61024 2/20 0.35
▸ SKP1 P63208 2/20 0.35
▸ SKP2 Q13309 2/20 0.35

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
SCHEMBL5515537 0.82 CNR1 (0.73) PTPN11CNR1CNR2METCKS1B
SCHEMBL14802426 0.74 GPR119 (0.49) HTR7
SCHEMBL5520242 0.71 CNR1 (0.59) PTPN11CNR1CNR2KDM1AMET
SCHEMBL4691460 0.71 CNR2 (0.41) PTPN11CNR1CNR2HRH4HTR1A
SCHEMBL14545578 0.70 CNR1 (0.62) PTPN11CNR1CKS1BSKP1SKP2
SCHEMBL17416946 0.69 PTPN11 (0.42) PTPN11HRH3KDM1AEGLN2SCN9A
SCHEMBL617262 0.68 FAAH (0.59) HRH3CHEK1FAAH
SCHEMBL14545302 0.68 CNR1 (0.80) PTPN11CNR1CNR2CKS1BSKP1
SCHEMBL14545384 0.67 CNR1 (0.77) PTPN11CNR1CNR2CKS1BSKP1
SCHEMBL11490910 0.67 L3MBTL1 (0.40) CNR2ADRA2AMET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070078135-A1 Substituted heteroaryl CB1 antagonists NEUROGEN CORPORATION (US) 2007-04-05 — — US disclosed
US-20070078135-A1 Substituted heteroaryl CB1 antagonists NEUROGEN CORPORATION (US) 2007-04-05 — — 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-20070078135-A1 Substituted heteroaryl CB1 antagonists CNR1, CNR2, OPRL1 PTPN11 3050/4885CNR1 1/4885CNR2 2/4885

“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.

Send feedback