SCHEMBL4515741

SCHEMBL4515741

COc1ccc2cc(C(=O)Nc3ccc(CN4CCCC4)cc3)c(=O)oc2c1OC(C)C

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
CNR2 P34972 8/20 0.54
MAPT P10636 2/20 0.51
TP53 P04637 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CYP1A2 P05177 1/20 0.49
KMT2A Q03164 1/20 0.48
BACE1 P56817 1/20 0.48
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47

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
SCHEMBL3947247 0.90 LMNA (0.57) LMNACNR2MAPTTP53SMN1; SMN2
SCHEMBL4519393 0.89 LMNA (0.57) LMNACNR2MAPTTP53SMN1; SMN2
SCHEMBL3885792 0.89 CNR2 (0.47) LMNACNR2MAPTTP53BACE1
SCHEMBL3885678 0.86 LMNA (0.58) LMNACNR2MAPTTP53SMN1; SMN2
SCHEMBL3878869 0.86 TP53 (0.59) CNR2MAPTTP53MAOAMAOB
SCHEMBL4524105 0.85 TP53 (0.55) CNR2MAPTTP53MAOAMAOB
SCHEMBL3888340 0.84 S1PR1 (0.59) LMNACNR2MAPTTP53SMN1; SMN2
SCHEMBL4559602 0.84 LMNA (0.56) LMNAMAPTTP53SMN1; SMN2CYP1A2
SCHEMBL3955610 0.84 TP53 (0.55) CNR2MAPTTP53MAOAMAOB
SCHEMBL4515009 0.84 S1PR1 (0.59) LMNACNR2MAPTTP53SMN1; SMN2

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-20090318546-A1 Chromen-2-One Derivatives NOVARTIS AG (CH) 2009-12-24 US claimed

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-20090318546-A1 Chromen-2-One Derivatives CYP1A2, CYP4B1, CYP1B1 LMNA 4113/4885CNR2 538/4885MAPT 3872/4885

“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.