SCHEMBL6069767

SCHEMBL6069767

CCC(c1ccc2c(c1)NC(=O)C1CCCC21)N(Cc1cccc(Cl)c1)C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.34
GHSR Q92847 4/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
WDR5 P61964 1/20 0.32
MDM2 Q00987 4/20 0.32
TP53 P04637 3/20 0.32
TRPM8 Q7Z2W7 1/20 0.32
TACR1 P25103 2/20 0.31
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31
CXCR3 P49682 1/20 0.31
NPC1 O15118 1/20 0.31
HTT P42858 1/20 0.31
CTSL P07711 1/20 0.31

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
SCHEMBL6069534 0.91 RIPK1 (0.34) RIPK1GHSRL3MBTL1ALDH1A1GAA
SCHEMBL6069728 0.83 GHSR (0.40) RIPK1GHSRL3MBTL1ALDH1A1GAA
SCHEMBL6069638 0.83 GHSR (0.36) RIPK1GHSRL3MBTL1ALDH1A1GAA
SCHEMBL6069521 0.82 NOS3 (0.50) RIPK1GHSRTRPM8
SCHEMBL6069720 0.82 GHSR (0.36) RIPK1GHSRL3MBTL1ALDH1A1GAA
SCHEMBL6069643 0.76 GHSR (0.36) RIPK1GHSRL3MBTL1ALDH1A1GAA
SCHEMBL6069609 0.76 TACR1 (0.34) RIPK1GHSRL3MBTL1ALDH1A1GAA
SCHEMBL6069738 0.75 NOS3 (0.39) GHSRHTT
SCHEMBL6069731 0.75 GHSR (0.36) RIPK1GHSRL3MBTL1ALDH1A1GAA
SCHEMBL6069793 0.74 GHSR (0.39) RIPK1GHSRL3MBTL1ALDH1A1GAA

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-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

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 RIPK1 4151/4885GHSR 4522/4885L3MBTL1 4551/4885

“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.