SCHEMBL1974279

SCHEMBL1974279

CCCCNc1cccnc1Cl

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
NPC1 O15118 3/20 0.47
TLR8 Q9NR97 3/20 0.44
UTS2R Q9UKP6 3/20 0.44
TLR7 Q9NYK1 1/20 0.44
NR4A2 P43354 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.42
RAB9A P51151 3/20 0.42
KDM6B O15054 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
HTT P42858 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
CNR2 P34972 1/20 0.40

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
SCHEMBL8415045 0.82 GRM5 (0.50) NPC1SMN1; SMN2RAB9AHTTMEN1
SCHEMBL27660967 0.81 NPC1 (0.48) KDM4ENPSR1L3MBTL1NPC1TLR8
SCHEMBL19897481 0.79 BACE1 (0.54) NPC1TLR8UTS2RTLR7KDM6B
SCHEMBL30692781 0.79 NPC1 (0.47) KDM4ENPSR1L3MBTL1NPC1TLR8
SCHEMBL11149010 0.77 HTT (0.54) KDM4EL3MBTL1NPC1TLR8TLR7
SCHEMBL14031588 0.77 TLR8 (0.50) KDM4ENPSR1L3MBTL1TLR8UTS2R
SCHEMBL516228 0.76 UTS2R (0.49) KDM4ENPSR1L3MBTL1NPC1TLR8
SCHEMBL18992277 0.76 NPC1 (0.43) NPSR1L3MBTL1NPC1TLR8UTS2R
SCHEMBL309485 0.75 TLR8 (0.53) KDM4ENPSR1L3MBTL1TLR8UTS2R
SCHEMBL4711248 0.75 BACE1 (0.53) NPSR1L3MBTL1NPC1TLR8UTS2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8816086-B2 Process for preparing cannabinoid receptor ligands ABBVIE INC. (US) 2014-08-26 US disclosed
US-8816086-B2 Process for preparing cannabinoid receptor ligands ABBVIE INC. (US) 2014-08-26 US disclosed
US-8816086-B2 Process for preparing cannabinoid receptor ligands ABBVIE INC. (US) 2014-08-26 US disclosed
WO-2011075525-A1 PROCESS FOR PREPARING CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2011-06-23 WO disclosed
WO-2011075525-A1 PROCESS FOR PREPARING CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2011-06-23 WO disclosed
US-20110144343-A1 PROCESS FOR PREPARING CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2011-06-16 US disclosed
US-20110144343-A1 PROCESS FOR PREPARING CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2011-06-16 US disclosed
US-20110144343-A1 PROCESS FOR PREPARING CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2011-06-16 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-20110144343-A1 PROCESS FOR PREPARING CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, NPY1R KDM4E 1824/4885NPSR1 11/4885L3MBTL1 4497/4885

“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.