SCHEMBL6072883

SCHEMBL6072883

CNC(=O)c1cc(N(C)c2ccc3c(c2)CCN3C(C)=O)ccn1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 6/20 0.46
LMNA P02545 1/20 0.44
CYP11B1 P15538 6/20 0.43
CYP11B2 P19099 6/20 0.43
SYK P43405 1/20 0.43
HTR2C P28335 1/20 0.43
NPC1 O15118 1/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.39
TRIM24 O15164 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
SCHEMBL6072495 0.81 SYK (0.57) NOTUMLMNACYP11B1CYP11B2SYK
SCHEMBL6072211 0.81 LMNA (0.40) LMNACYP11B1CYP11B2SYKHTR2C
SCHEMBL6072207 0.77 HTR2C (0.40) LMNASYKHTR2CTP53MAPT
SCHEMBL6072881 0.76 LMNA (0.49) NOTUMLMNASYKTP53MAPT
SCHEMBL6071905 0.76 PARP1 (0.40) LMNATP53MAPT
SCHEMBL8528760 0.75 NOTUM (0.65) NOTUMLMNACYP11B1CYP11B2HTR2C
SCHEMBL6071927 0.71 KDR (0.52)
SCHEMBL6072414 0.70 KDR (0.52) NOTUM
SCHEMBL6072032 0.69 NOTUM (0.54) NOTUMCYP11B1CYP11B2SYKMAPT
SCHEMBL9094480 0.69 LMNA (0.66) NOTUMLMNACYP11B1CYP11B2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060241149-A1 Chemical compounds ADAMS JERRY L 2006-10-26 US disclosed
EP-1581514-A2 CHEMICAL COMPOUNDS SmithKline Beecham Corporation (US) 2005-10-05 EP disclosed
EP-1121365-B1 ORGANOBORON DERIVATIVES AND PROCESS FOR COUPLING ORGANIC COMPOUNDS COMMW SCIENT IND RES ORG (AU) 2005-06-08 EP disclosed
WO-2004043379-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed
US-6713566-B1 CATALYTIC HYDROBORATION OF OLEFINIC OR ACETYLENIC FUNCTIONA-LIZED MATERIAL UNDER MILD CONDITIONS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2004-03-30 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-20060241149-A1 Chemical compounds CHKB, MAP3K20, MAP3K6 NOTUM 672/4885LMNA 2570/4885CYP11B1 535/4885

“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.