SCHEMBL4332820

SCHEMBL4332820

O=C(NCc1ccccc1F)c1nc(-c2cccc(Cl)c2)n2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.45
TP53 P04637 3/20 0.44
MAPT P10636 1/20 0.43
CNR1 P21554 3/20 0.43
CACNA1G O43497 1/20 0.42
CACNA1H O95180 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ROCK1 Q13464 1/20 0.41
MAOB P27338 1/20 0.41
HSD17B13 Q7Z5P4 1/20 0.41
LMNA P02545 1/20 0.41
MDM2 Q00987 1/20 0.40
P2RX7 Q99572 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
SCHEMBL4329324 0.90 MAPT (0.46) CNR2TP53MAPTCNR1POLB
SCHEMBL4334935 0.86 PTGER4 (0.47) CNR2TP53MAPTCNR1POLB
SCHEMBL4320324 0.86 CNR2 (0.51) CNR2TP53CNR1MEN1KMT2A
SCHEMBL4331152 0.86 PTGER4 (0.50) CNR2TP53MEN1KMT2A
SCHEMBL13578095 0.86 TP53 (0.47) CNR2TP53MAPTCACNA1GCACNA1H
SCHEMBL4326415 0.85 KDM4E (0.49) CNR2TP53MAPTCNR1GAA
SCHEMBL4320342 0.84 ADORA2A (0.46) CNR2MAPTMEN1KMT2ALMNA
SCHEMBL13578183 0.82 CNR2 (0.49) CNR2TP53MAPTCNR1CACNA1G
Trifluoroacetic Acid SCHEMBL4327011 0.81 TP53 (0.44) CNR2TP53MAPTCNR1CACNA1G
SCHEMBL13578099 0.81 CCR1 (0.52) CNR2TP53CNR1POLBMEN1

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-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES MERCK & CO., INC. 2009-12-31 US disclosed
US-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES MERCK & CO., INC. 2009-12-31 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-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES CNR2, CNR1, TRPV1 CNR2 1/4885TP53 4788/4885MAPT 4674/4885

“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.