SCHEMBL6458616

SCHEMBL6458616

CCOc1cc(C(=O)NC2CCC(Nc3cc(C)c4ccccc4n3)CC2)cc(OCC)c1OCC

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
KDM4E B2RXH2 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MAPT P10636 4/20 0.50
RAB9A P51151 3/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ADRA2A P08913 4/20 0.46
MCHR1 Q99705 4/20 0.46
RXFP1 Q9HBX9 4/20 0.46
TP53 P04637 3/20 0.45
USP2 O75604 1/20 0.44

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
SCHEMBL6458607 1.00 LMNA (0.55) LMNAKDM4ESMN1; SMN2MAPTRAB9A
SCHEMBL6463284 0.87 SMN1; SMN2 (0.57) LMNAKDM4ESMN1; SMN2MAPTADRA2A
SCHEMBL6463274 0.87 SMN1; SMN2 (0.57) LMNAKDM4ESMN1; SMN2MAPTADRA2A
SCHEMBL6459395 0.83 SMN1; SMN2 (0.62) LMNAKDM4ESMN1; SMN2MAPTRAB9A
SCHEMBL6459407 0.83 SMN1; SMN2 (0.62) LMNAKDM4ESMN1; SMN2MAPTRAB9A
SCHEMBL6458000 0.82 LMNA (0.59) LMNAKDM4ESMN1; SMN2MAPTRAB9A
SCHEMBL6458010 0.82 LMNA (0.59) LMNAKDM4ESMN1; SMN2MAPTRAB9A
Hydrochloric Acid SCHEMBL6457804 0.81 LMNA (0.58) LMNAKDM4ESMN1; SMN2MAPTRAB9A
Hydrochloric Acid SCHEMBL6457796 0.81 LMNA (0.58) LMNAKDM4ESMN1; SMN2MAPTRAB9A
SCHEMBL6462123 0.81 LMNA (0.58) LMNAKDM4ESMN1; SMN2MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof TAISHO PHARMACEUTICAL CO., LTD. 2005-09-08 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-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof HCRTR2, MCHR1, MCHR2 LMNA 3391/4885KDM4E 1190/4885SMN1; SMN2 1477/4885

“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.