SCHEMBL2637486

SCHEMBL2637486

O=C1NCCC12CCN(S(=O)(=O)c1cccc(OC(F)(F)F)c1)CC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
LIPE Q05469 1/20 0.44
SCN9A Q15858 2/20 0.42
CYP11B1 P15538 2/20 0.42
KDM2B Q8NHM5 1/20 0.42
CYP17A1 P05093 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP21A2 P08686 1/20 0.42
CYP19A1 P11511 1/20 0.42
CYP7A1 P22680 1/20 0.42
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP11B2 P19099 1/20 0.41
OTUD7B Q6GQQ9 2/20 0.40
AKR1C3 P42330 1/20 0.39
PKM P14618 1/20 0.39
PKLR P30613 1/20 0.39
DDB1 Q16531 1/20 0.39

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
SCHEMBL2637431 0.94 MEN1 (0.45) MEN1KMT2ALIPESCN9ACYP11B1
SCHEMBL2637626 0.87 MEN1 (0.54) MEN1KMT2ALIPEPRCP
SCHEMBL2635298 0.87 KDM2B (0.41) MEN1KMT2ASCN9ACYP11B1KDM2B
SCHEMBL2637346 0.87 KDM2B (0.42) MEN1KMT2AKDM2BLMNATSHR
SCHEMBL2637598 0.84 HTT (0.54) MEN1KMT2ALMNAPKMPKLR
SCHEMBL2635565 0.83 KDM2B (0.41) MEN1KMT2ASCN9ACYP11B1KDM2B
SCHEMBL2637344 0.83 S100A9 (0.43) MEN1KMT2ALIPEMAPK1PRCP
SCHEMBL2637735 0.81 MEN1 (0.52) MEN1KMT2ALIPEPRCP
SCHEMBL25145662 0.81 PKM (0.55) MEN1KMT2ALIPESCN9ACYP11B1
SCHEMBL2637657 0.81 KDM2B (0.41) MEN1KMT2AKDM2BLMNATSHR

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-20130116270-A1 NOVEL COMPOUNDS CONVERGENCE PHARMACEUTICALS LIMTED 2013-05-09 US claimed
EP-2569318-A1 NOVEL COMPOUNDS Convergence Pharmaceuticals Limited (GB) 2013-03-20 EP claimed
WO-2011141729-A1 NOVEL COMPOUNDS Convergence Pharmaceuticals Limited (GB) 2011-11-17 WO claimed
US-20130116270-A1 NOVEL COMPOUNDS CONVERGENCE PHARMACEUTICALS LIMTED 2013-05-09 US disclosed
US-20130116270-A1 NOVEL COMPOUNDS CONVERGENCE PHARMACEUTICALS LIMTED 2013-05-09 US disclosed
US-20130116270-A1 NOVEL COMPOUNDS CONVERGENCE PHARMACEUTICALS LIMTED 2013-05-09 US disclosed
EP-2569318-A1 NOVEL COMPOUNDS Convergence Pharmaceuticals Limited (GB) 2013-03-20 EP disclosed
WO-2011141729-A1 NOVEL COMPOUNDS Convergence Pharmaceuticals Limited (GB) 2011-11-17 WO disclosed
WO-2011141729-A1 NOVEL COMPOUNDS Convergence Pharmaceuticals Limited (GB) 2011-11-17 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-20130116270-A1 NOVEL COMPOUNDS TRPV2, CACNA1C, CACNA1B MEN1 3951/4885KMT2A 4275/4885LIPE 4446/4885

“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.