SCHEMBL6070032

SCHEMBL6070032

CC(=O)OC(C)c1ccc2c(c1)NC(=O)C1CCCC21

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.35
LMNA P02545 1/20 0.32
PDE4A P27815 4/20 0.31
PDE4B Q07343 4/20 0.31
PDE4C Q08493 4/20 0.31
PDE4D Q08499 4/20 0.31
GAA P10253 1/20 0.30
TSHR P16473 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL6069808 0.82 NOX1 (0.37) LMNAGAATSHRNPC1RAB9A
SCHEMBL6137666 0.81 PTGS1 (0.40) LMNASMN1; SMN2
SCHEMBL6069800 0.81 MT-CO2 (0.40)
SCHEMBL6069681 0.79 LMNA (0.31) LMNA
SCHEMBL6070036 0.73 FKBP1A (0.35) NAAATSHR
SCHEMBL6642433 0.72 NOS3 (0.44) GAATSHR
SCHEMBL6643305 0.71 NOS3 (0.48) LMNATSHRNPC1SMN1; SMN2
SCHEMBL6069744 0.71 HSD17B10 (0.46) GAASMN1; SMN2
SCHEMBL6070084 0.71 MT-CO2 (0.40) GAA
SCHEMBL6645276 0.69 NOS3 (0.44) NPC1

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-7067667-B2 Aminoalkyl-3, 4-dihydroquinoline derivatives as no-synthase inhibitors SCHERING AKTIENGESELLSCHAFT (DE) 2006-06-27 US disclosed
US-20040127712-A1 Aminoalkyl-3, 4-dihydroquinoline derivatives as no-synthase inhibitors JAROCH STEFAN (DE) 2004-07-01 US disclosed
EP-1115708-B1 AMINOALKYL-3,4-DIHYDROQUINOLINE DERIVATES AS NO-SYNTHASE INHIBITORS SCHERING AG (DE) 2004-04-14 EP disclosed
EP-1115708-A1 AMINOALKYL-3,4-DIHYDROQUINOLINE DERIVATES AS NO-SYNTHASE INHIBITORS Schering Aktiengesellschaft (DE) 2001-07-18 EP disclosed
WO-2000017167-A1 AMINOALKYL-3,4-DIHYDROQUINOLINE DERIVATES AS NO-SYNTHASE INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2000-03-30 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-20040127712-A1 Aminoalkyl-3, 4-dihydroquinoline derivatives as no-synthase inhibitors NOS3, NOS1, NOS2 NAAA 127/4885LMNA 3738/4885PDE4A 28/4885

“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.