SCHEMBL5577266

SCHEMBL5577266

COc1cccc(CN(Cc2ccccc2C2CCN(Cc3ccc(F)cc3)CC2)S(C)(=O)=O)c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.46
KMT2A Q03164 6/20 0.46
SIGMAR1 Q99720 2/20 0.44
ATM Q13315 1/20 0.43
MAPK1 P28482 1/20 0.43
CACNA1G O43497 1/20 0.42
CCR3 P51677 2/20 0.42
TACR1 P25103 1/20 0.41
OPRM1 P35372 1/20 0.41

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
SCHEMBL5577766 0.91 APLNR (0.48) MEN1KMT2ASIGMAR1ATMCCR3
SCHEMBL5577935 0.89 SIGMAR1 (0.48) MEN1KMT2ASIGMAR1ATMOPRM1
SCHEMBL5577267 0.89 DRD2 (0.42) MEN1KMT2ASIGMAR1ATMMAPK1
SCHEMBL5577994 0.88 MEN1 (0.48) MEN1KMT2ASIGMAR1
SCHEMBL5577351 0.87 MEN1 (0.54) MEN1KMT2ASIGMAR1ATMMAPK1
SCHEMBL5577452 0.86 MEN1 (0.45) MEN1KMT2ASIGMAR1ATMMAPK1
SCHEMBL5577284 0.85 MCHR1 (0.43) MEN1KMT2ASIGMAR1MAPK1
SCHEMBL5577707 0.85 MEN1 (0.45) MEN1KMT2ASIGMAR1ATM
SCHEMBL5577670 0.84 MEN1 (0.49) MEN1KMT2ASIGMAR1CACNA1GCCR3
SCHEMBL5577731 0.84 MEN1 (0.51) MEN1KMT2ASIGMAR1CACNA1GCCR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070043079-A1 Heterocyclic compound containing nitrogen atom and use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-02-22 US disclosed
EP-1616862-A1 NITROGENOUS HETEROCYCLIC COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-01-18 EP 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-20070043079-A1 Heterocyclic compound containing nitrogen atom and use thereof HLA-DRB1, MIF, HLA-C MEN1 748/4885KMT2A 3527/4885SIGMAR1 3281/4885

“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.