SCHEMBL4188664

SCHEMBL4188664

O=C(O)Nc1ccccc1NC(=O)c1ccc2c(c1)CCC2NC(=O)n1ccnc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAOK3 Q9H2K8 2/20 0.39
TAOK1 Q7L7X3 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
TRPV1 Q8NER1 8/20 0.37
LMNA P02545 1/20 0.36
TAS1R3 Q7RTX0 2/20 0.36
TAS1R1 Q7RTX1 2/20 0.36
ROCK2 O75116 1/20 0.36
TP53 P04637 1/20 0.36
NR3C1 P04150 1/20 0.35
MAPT P10636 1/20 0.35
MAPK13 O15264 1/20 0.35

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
SCHEMBL13653131 0.87 TRPV1 (0.39) PDE4APDE4BPDE4CPDE4DTRPV1
SCHEMBL4184531 0.80 CA12 (0.50) PDE4APDE4BPDE4CPDE4DTRPV1
SCHEMBL23978759 0.78 TAOK1 (0.48) TAOK3TAOK1PDE4APDE4BPDE4C
SCHEMBL4186869 0.77 NAMPT (0.48) TRPV1NR3C1MAPT
SCHEMBL4182639 0.77 MEN1 (0.54) PDE4APDE4BPDE4CPDE4DTRPV1
SCHEMBL4185657 0.76 KMT2A (0.45) TAOK3TAOK1LMNA
SCHEMBL4183406 0.75 KMT2A (0.44) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL4188741 0.75 HDAC1 (0.45) CYP1A2CYP3A4CYP2C9CYP2C19TRPV1
SCHEMBL4190658 0.74 HDAC1 (0.50) PDE4APDE4BPDE4CPDE4DTRPV1
SCHEMBL4191098 0.74 HDAC1 (0.50) PDE4APDE4BPDE4CPDE4DTRPV1

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-20090247590-A1 Indane amides BAYER PHARMACEUTICLAS CORPORATION (US) 2009-10-01 US disclosed
EP-1802577-A1 INDANE AMIDES WITH ANTIPROLIFERATIVE ACTIVITY Bayer Pharmaceuticals Corporation (US) 2007-07-04 EP disclosed
WO-2006062580-A1 INDANE AMIDES WITH ANTIPROLIFERATIVE ACTIVITY BAYER PHARMACEUTICALS CORPORATION (US) 2006-06-15 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-20090247590-A1 Indane amides MKI67, PPIP5K2, CCNA1 TAOK3 4189/4885TAOK1 4249/4885CYP1A2 508/4885

“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.