SCHEMBL6833206

SCHEMBL6833206

CCCNCc1ccc(OC)c2oc(C(=O)NC3CCCCC3)cc12

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.47
ADRA2A P08913 2/20 0.46
ADRA2B P18089 2/20 0.46
ADRA2C P18825 2/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ADORA2A P29274 2/20 0.45
ADORA2B P29275 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44
EPHX1 P07099 1/20 0.44
ADORA1 P30542 1/20 0.43
ALDH1A1 P00352 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL6837544 0.99 ADRA2A (0.47) CNR2ADRA2AADRA2BADRA2CMEN1
SCHEMBL6833219 0.97 ADRA2A (0.47) CNR2ADRA2AADRA2BADRA2CMEN1
SCHEMBL6838038 0.94 CNR2 (0.49) CNR2ADRA2AADRA2BADRA2CMEN1
SCHEMBL6837605 0.93 CNR2 (0.47) CNR2ADRA2AADRA2BADRA2CMEN1
SCHEMBL6837310 0.93 ADRA2A (0.47) CNR2ADRA2AADRA2BADRA2CMEN1
SCHEMBL6836637 0.92 ADRA2A (0.47) CNR2ADRA2AADRA2BADRA2CMEN1
SCHEMBL6837675 0.91 ADRA2A (0.46) CNR2ADRA2AADRA2BADRA2CMEN1
SCHEMBL6837918 0.90 ADRA2A (0.47) CNR2ADRA2AADRA2BADRA2CMEN1
SCHEMBL6837851 0.89 MEN1 (0.48) CNR2ADRA2AADRA2BADRA2CMEN1
SCHEMBL6837591 0.89 MEN1 (0.48) CNR2ADRA2AADRA2BADRA2CMEN1

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-6716987-B1 PHOSPHODIESTERASE IV INHIBITORS KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-04-06 US disclosed
US-6514996-B2 Derivatives of benzofuran or benzodioxole KYOWA HAKKO KOGYO CO., LTD. (JP) 2003-02-04 US disclosed
US-20020128290-A1 DERIVATIVES OF BENZOFURAN OR BENZODIOXOLE KYOWA HAKKO KOGYO CO., LTD. (JP) 2002-09-12 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-20020128290-A1 DERIVATIVES OF BENZOFURAN OR BENZODIOXOLE CBR1, CBR3, CYC1 CNR2 739/4885ADRA2A 1965/4885ADRA2B 1631/4885

“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.