SCHEMBL4932883

SCHEMBL4932883

CCOC(=O)c1nn(-c2ccc(Cl)cc2F)c2c1C1CCC2C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.54
CNR2 P34972 2/20 0.54
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 2/20 0.41
CXCR3 P49682 1/20 0.41
ALDH1A1 P00352 3/20 0.41
TLR4 O00206 1/20 0.40
GABRG2 P18507 3/20 0.39
GABRB3 P28472 3/20 0.39
GABRA5 P31644 3/20 0.39
GABRA2 P47869 2/20 0.39
GABRB2 P47870 2/20 0.39
GABRA1 P14867 1/20 0.39
GABRA3 P34903 1/20 0.39
GABRA4 P48169 1/20 0.39
GABRA6 Q16445 1/20 0.39

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
SCHEMBL1432762 0.90 KDM4E (0.53) CNR1CNR2KDM4EMEN1MAPT
SCHEMBL1432489 0.90 CNR2 (0.66) CNR1CNR2KDM4EMAPTNPSR1
SCHEMBL4934580 0.87 CNR1 (0.51) CNR1CNR2KDM4EMEN1MAPT
SCHEMBL4931540 0.86 CNR1 (0.54) CNR1CNR2KDM4EMEN1MAPT
SCHEMBL4934269 0.84 CNR2 (0.58) CNR1CNR2KMT2A
SCHEMBL4933157 0.84 CNR2 (0.58) CNR1CNR2KMT2A
SCHEMBL4929203 0.84 CNR2 (0.58) CNR1CNR2KMT2A
SCHEMBL1432222 0.84 CNR2 (0.57) CNR1CNR2KDM4EMAPTNPSR1
SCHEMBL1432107 0.83 KMT2A (0.50) KDM4EMEN1MAPTKMT2ANPSR1
SCHEMBL1432843 0.82 PDE4B (0.52) CNR1CNR2KDM4EMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200501-A1 NOVEL CANNABINOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESSES FOR THEIR PREPARATION GLENMARK PHARMACEUTICALS S.A. (CH) 2008-08-21 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-20080200501-A1 NOVEL CANNABINOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESSES FOR THEIR PREPARATION CNR2, CNR1, OPRL1 CNR1 2/4885CNR2 1/4885KDM4E 2084/4885

“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.