SCHEMBL3889085

SCHEMBL3889085

CCCc1c(OCC)ccc2cc(C(=O)Nc3ccc(CN4CCCC4)cc3)c(=O)oc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 5/20 0.50
LMNA P02545 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.45
MAPK1 P28482 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
MAPT P10636 3/20 0.45
TP53 P04637 1/20 0.45
THRB P10828 1/20 0.44
CACNA1B Q00975 1/20 0.43
APBA1 Q02410 1/20 0.43
SAE1 Q9UBE0 1/20 0.43
UBA2 Q9UBT2 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
TSHR P16473 1/20 0.43
KMT2A Q03164 1/20 0.43
CNR2 P34972 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL3945831 0.93 CACNA1B (0.52) S1PR1LMNASMN1; SMN2MAPK1NPC1
SCHEMBL3888340 0.92 S1PR1 (0.59) S1PR1LMNASMN1; SMN2MAPTTP53
SCHEMBL3885614 0.92 S1PR1 (0.47) S1PR1LMNASMN1; SMN2MAPK1MAPT
SCHEMBL4515009 0.92 S1PR1 (0.59) S1PR1LMNASMN1; SMN2MAPTTP53
SCHEMBL4507775 0.90 S1PR1 (0.45) S1PR1LMNASMN1; SMN2MAPK1NPC1
SCHEMBL4511085 0.89 S1PR1 (0.48) S1PR1LMNASMN1; SMN2MAPK1MAPT
SCHEMBL4515819 0.89 S1PR1 (0.48) S1PR1LMNASMN1; SMN2MAPK1MAPT
SCHEMBL3955854 0.89 S1PR1 (0.46) S1PR1MAPTTP53MAOAMAOB
SCHEMBL4358231 0.89 S1PR1 (0.46) S1PR1MAPTTP53MAOAMAOB
SCHEMBL3880281 0.88 S1PR1 (0.46) S1PR1MAPTTP53CACNA1BAPBA1

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-20090318546-A1 Chromen-2-One Derivatives NOVARTIS AG (CH) 2009-12-24 US claimed
EP-2010511-A1 CHROMEN-2-ONE DERIVATIVES Novartis AG (CH) 2009-01-07 EP claimed
WO-2007115820-A1 CHROMEN-2-ONE DERIVATIVES NOVARTIS AG (CH) 2007-10-18 WO 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 S1PR1 3084/4885LMNA 4113/4885SMN1; SMN2 1996/4885

“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.