SCHEMBL3579185

SCHEMBL3579185

CC(C)c1oc2c(C=O)c(OCc3ccccc3)ccc2c(=O)c1-c1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.43
MAPT P10636 3/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
CYP19A1 P11511 1/20 0.38
PIK3CD O00329 3/20 0.37
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 2/20 0.37
POLB P06746 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
XBP1 P17861 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KCNA3 P22001 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 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
SCHEMBL3584938 0.86 GAA (0.46) ARMAPTESR1ESR2CYP19A1
SCHEMBL3586172 0.85 CYP19A1 (0.41) SMN1; SMN2CYP19A1PIK3CDALDH1A1KDM4E
SCHEMBL3584855 0.78 GAA (0.52) ARMAPTESR1ESR2ALDH1A1
SCHEMBL3584846 0.76 ALPL (0.40) ALDH1A1KDM4EPOLBMEN1KMT2A
SCHEMBL3578828 0.70 KMT2A (0.36) ARESR1ESR2CYP19A1ALDH1A1
SCHEMBL3589603 0.70 GAA (0.45) ALDH1A1KDM4EPOLBMEN1KMT2A
SCHEMBL3587585 0.69 ALPL (0.36) ALDH1A1KDM4EMAOAGAACYP1A1
SCHEMBL3584054 0.69 CA1 (0.45) ALDH1A1KDM4EPOLBMEN1KMT2A
SCHEMBL14185181 0.69 GAA (0.48) MAPTALDH1A1KDM4EPOLBMEN1
SCHEMBL14185221 0.69 ERN1 (0.46) ARMAPTNPC1RAB9ASMN1; 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7732435-B2 Chromone derivatives useful as antagonists of VR1 receptors NOVARTIS AG (CH) 2010-06-08 US disclosed
US-20080312316-A1 Chromone Derivatives Useful as Antagonists of Vr1 Receptors CULSHAW ANDREW JAMES 2008-12-18 US disclosed
CN-101321765-A Chromone derivatives useful as antagonists of VR1 receptors NOVARTIS AG (CH) 2008-12-10 CN disclosed
EP-1963334-A1 CHROMONE DERIVATIVES USEFUL AS ANTAGONISTS OF VR1 RECEPTORS Novartis AG (CH) 2008-09-03 EP disclosed
US-20080114056-A1 Chromone Derivatives Useful as Vanilloid Antagonists NOVARTIS AG (CH) 2008-05-15 US disclosed
CN-1993344-A Chromone derivatives useful as vanilloid antagonists NOVARTIS AG (CH) 2007-07-04 CN disclosed
WO-2007065888-A1 CHROMONE DERIVATIVES USEFUL AS ANTAGONISTS OF VR1 RECEPTORS NOVARTIS AG (CH) 2007-06-14 WO disclosed
EP-1756080-A1 CHROMONE DERIVATIVES USEFUL AS VANILLOID ANTAGONISTS Novartis AG (CH) 2007-02-28 EP disclosed
WO-2005121116-A1 CHROMONE DERIVATIVES USEFUL AS VANILLOID ANTAGONISTS NOVARTIS AG (CH) 2005-12-22 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 (2 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-20080114056-A1 Chromone Derivatives Useful as Vanilloid Antagonists TRPV1, CHRM3, TRPV3 AR 419/4885MAPT 4741/4885NPC1 1721/4885
US-20080312316-A1 Chromone Derivatives Useful as Antagonists of Vr1 Receptors VRK1, VRK2, ARRB1 AR 438/4885MAPT 4798/4885NPC1 1648/4885

“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.