SCHEMBL3523616

SCHEMBL3523616

CNC(=O)Cc1noc2cc(Br)ccc12

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
TP53 P04637 3/20 0.47
SMN1; SMN2 Q16637 5/20 0.45
RAB9A P51151 5/20 0.45
NPC1 O15118 4/20 0.45
HPGD P15428 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
KDM4E B2RXH2 3/20 0.45
MAPT P10636 4/20 0.43
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
PRNP P04156 1/20 0.39
POLB P06746 2/20 0.38
ACHE P22303 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL3525728 0.86 RAB9A (0.48) LMNATP53SMN1; SMN2RAB9ANPC1
SCHEMBL32670475 0.83 MAPT (0.43) LMNATP53SMN1; SMN2RAB9ANPC1
SCHEMBL3522105 0.83 RAB9A (0.44) LMNATP53SMN1; SMN2RAB9ANPC1
SCHEMBL3526590 0.83 HTR2A (0.45) LMNATP53SMN1; SMN2RAB9ANPC1
SCHEMBL3524883 0.82 MAPT (0.56) LMNATP53SMN1; SMN2RAB9ANPC1
SCHEMBL3525870 0.81 RAB9A (0.43) LMNATP53SMN1; SMN2RAB9ANPC1
SCHEMBL3520615 0.80 ACHE (0.43) LMNATP53SMN1; SMN2RAB9ANPC1
SCHEMBL14303912 0.80 RAB9A (0.67) LMNATP53SMN1; SMN2RAB9ANPC1
SCHEMBL24754290 0.78 MAPT (0.43) LMNATP53SMN1; SMN2RAB9ANPC1
SCHEMBL31323471 0.78 MAPT (0.43) LMNATP53SMN1; SMN2RAB9ANPC1

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-7642276-B2 Fused heteroaryl derivatives for use as P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2010-01-05 US disclosed
US-7642276-B2 Fused heteroaryl derivatives for use as P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2010-01-05 US disclosed
US-7642276-B2 Fused heteroaryl derivatives for use as P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2010-01-05 US disclosed
EP-1531812-B1 FUSED HETEROARYL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS IN THE TREATMENT OF I.A. RHEUMATOID ARTHRITIS SMITHKLINE BEECHAM CORP (US) 2007-06-27 EP disclosed
US-20060122221-A1 Fused heteroaryl derivatives for use as p38 kinase inhibitors in the treatment of i.a. rheumatoid arthristis SMITHKLINE BEECHAM CORPORATION 2006-06-08 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-20060122221-A1 Fused heteroaryl derivatives for use as p38 kinase inhibitors in the treatment of i.a. rheumatoid arthristis MAPK7, CNKSR1, MAPK1 LMNA 3838/4885TP53 2766/4885SMN1; SMN2 4507/4885

“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.