SCHEMBL6837816

SCHEMBL6837816

COc1ccc(CN2CCCC2)c2cc(C(=O)Nc3ccc(Cl)cc3)oc12

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.59
ADRA2A P08913 4/20 0.51
ADRA2B P18089 4/20 0.51
ADRA2C P18825 4/20 0.51
MCHR1 Q99705 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 2/20 0.47
F2 P00734 1/20 0.46
F10 P00742 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
PTGER1 P34995 3/20 0.45
ACHE P22303 1/20 0.45
TP53 P04637 1/20 0.45
THRB P10828 1/20 0.45
KDM4E B2RXH2 2/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL6836438 0.93 F10 (0.55) LMNAADRA2AADRA2BADRA2CF2
SCHEMBL6837782 0.91 ADRA2A (0.51) LMNAADRA2AADRA2BADRA2CSMN1; SMN2
SCHEMBL6837970 0.90 ADRA2A (0.52) LMNAADRA2AADRA2BADRA2CSMN1; SMN2
SCHEMBL6837901 0.89 ADRA2A (0.51) LMNAADRA2AADRA2BADRA2CKMT2A
SCHEMBL6839052 0.89 ADRA2A (0.53) LMNAADRA2AADRA2BADRA2CSMN1; SMN2
SCHEMBL6838117 0.84 ADRA2A (0.52) ADRA2AADRA2BADRA2CKMT2AALDH1A1
SCHEMBL6836858 0.83 ADRA2A (0.51) LMNAADRA2AADRA2BADRA2CSMN1; SMN2
SCHEMBL6836474 0.83 ADRA2A (0.43) LMNAADRA2AADRA2BADRA2CSMN1; SMN2
SCHEMBL6837898 0.83 ADRA2A (0.53) LMNAADRA2AADRA2BADRA2CSMN1; SMN2
SCHEMBL6837503 0.82 POLB (0.51) LMNASMN1; SMN2KMT2AALDH1A1ACHE

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 LMNA 1848/4885ADRA2A 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.