SCHEMBL9893070

SCHEMBL9893070

CCCc1cc(NC(C)=O)on1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.47
RPS6KA2 Q15349 1/20 0.45
ADORA2B P29275 1/20 0.41
CA2 P00918 4/20 0.41
CA7 P43166 3/20 0.41
CA1 P00915 2/20 0.41
CA4 P22748 2/20 0.41
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
RAB9A P51151 5/20 0.39
HPGD P15428 1/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
LMNA P02545 1/20 0.39
PPARA Q07869 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL10806751 0.86 CA2 (0.44) MAPK14RPS6KA2CA2CA7CA1
SCHEMBL9891802 0.84 MAPK14 (0.48) MAPK14RPS6KA2ADORA2BALDH1A1SMN1; SMN2
SCHEMBL9892349 0.83 MAPK14 (0.44) MAPK14RPS6KA2ADORA2BALDH1A1SMN1; SMN2
SCHEMBL11738978 0.83 MAPK14 (0.44) MAPK14RPS6KA2ADORA2BALDH1A1SMN1; SMN2
SCHEMBL9893071 0.79 MAPK14 (0.56) MAPK14CA2CA7CA1CA4
SCHEMBL7588423 0.78 ALDH1A1 (0.40) MAPK14CA2CA7CA1CA4
SCHEMBL9713191 0.77 MAPK14 (0.48) MAPK14RPS6KA2ADORA2BALDH1A1SMN1; SMN2
SCHEMBL16542496 0.75 MAPK14 (0.37) MAPK14RPS6KA2ADORA2BALDH1A1SMN1; SMN2
SCHEMBL9712816 0.74 CYP1A2 (0.55) MAPK14ALDH1A1SMN1; SMN2HSD17B10RAB9A
SCHEMBL25288005 0.74 ALDH1A1 (0.47) MAPK14CA2CA7ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8629157-B2 Pyrrolidine compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-14 US disclosed
US-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-07 US disclosed
WO-2010077836-A2 PYRROLIDINE COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-07-08 WO 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-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 MAPK14 1949/4885RPS6KA2 643/4885ADORA2B 130/4885

“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.