SCHEMBL641466

SCHEMBL641466

CCCCOc1ccc(-c2ccc(C(=O)Nc3ccccc3CP(=O)(O)O)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 3/20 0.57
SMN1; SMN2 Q16637 3/20 0.49
LMNA P02545 2/20 0.49
STAT3 P40763 1/20 0.49
MAPT P10636 3/20 0.48
RXFP1 Q9HBX9 1/20 0.48
SUCNR1 Q9BXA5 1/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
NR1H4 Q96RI1 2/20 0.48
TP53 P04637 2/20 0.48
HSD17B10 Q99714 1/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
RARB P10826 3/20 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
SCHEMBL644422 0.97 PLK1 (0.63) PLK1SMN1; SMN2LMNASTAT3MAPT
SCHEMBL642937 0.97 PLK1 (0.63) PLK1SMN1; SMN2LMNASTAT3MAPT
SCHEMBL26671910 0.93 PLK1 (0.67) PLK1SMN1; SMN2LMNASTAT3MAPT
SCHEMBL644677 0.86 PLK1 (0.61) PLK1MAPTSUCNR1NR1H4MEN1
SCHEMBL641661 0.86 F10 (0.63) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL642216 0.85 PLK1 (0.60) PLK1SMN1; SMN2LMNAMAPTRXFP1
SCHEMBL642223 0.84 SMN1; SMN2 (0.62) SMN1; SMN2LMNAMAPTRXFP1NPC1
SCHEMBL642217 0.83 PLK1 (0.55) PLK1MAPTRXFP1SUCNR1NR1H4
SCHEMBL642590 0.83 PLK1 (0.61) PLK1MAPTMEN1KMT2ARARB
SCHEMBL641510 0.83 DHODH (0.57) SMN1; SMN2LMNAMAPTRXFP1SUCNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2057173-B1 AMIDES AS SPHINGOMYELINE INHIBITORS NOVARTIS AG (CH) 2014-02-26 EP claimed
US-8119617-B2 aSMase inhibitors NOVARTIS AG (CH) 2012-02-21 US claimed
US-20100022482-A1 aSMase inhibitors NOVARTIS AG (CH) 2010-01-28 US claimed
EP-2057173-A1 AMIDES AS SPHINGOMYELINE INHIBITORS Novartis AG (CH) 2009-05-13 EP claimed
WO-2008022771-A1 AMIDES AS SPHINGOMYELINE INHIBITORS NOVARTIS AG (CH) 2008-02-28 WO claimed
EP-2057173-B1 AMIDES AS SPHINGOMYELINE INHIBITORS NOVARTIS AG (CH) 2014-02-26 EP disclosed
US-8119617-B2 aSMase inhibitors NOVARTIS AG (CH) 2012-02-21 US disclosed
US-20100022482-A1 aSMase inhibitors NOVARTIS AG (CH) 2010-01-28 US disclosed
EP-2057173-A1 AMIDES AS SPHINGOMYELINE INHIBITORS Novartis AG (CH) 2009-05-13 EP disclosed
WO-2008022771-A1 AMIDES AS SPHINGOMYELINE INHIBITORS NOVARTIS AG (CH) 2008-02-28 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-20100022482-A1 aSMase inhibitors SMPD1, SMPD3, SMPD2 PLK1 1883/4885SMN1; SMN2 774/4885LMNA 1589/4885

“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.