SCHEMBL5577520

SCHEMBL5577520

CCNC(=O)N(Cc1ccccc1C)Cc1ccccc1C1CCN(Cc2ccc(F)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.45
GAA P10253 2/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
MCHR1 Q99705 4/20 0.42
EGFR P00533 1/20 0.41
ERBB2 P04626 1/20 0.41
CACNA1G O43497 3/20 0.41
CHRM4 P08173 2/20 0.41
HRH3 Q9Y5N1 1/20 0.41
SLC6A12 P48065 1/20 0.40
TMEM97 Q5BJF2 1/20 0.40

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
SCHEMBL5577702 0.92 MCHR1 (0.51) SIGMAR1GAAKDM4ELMNAMCHR1
SCHEMBL5577834 0.92 GAA (0.52) SIGMAR1GAAKDM4ELMNAMCHR1
SCHEMBL5577271 0.91 MEN1 (0.45) SIGMAR1GAAKDM4ELMNAMCHR1
SCHEMBL5577823 0.90 HRH3 (0.47) SIGMAR1GAAKDM4ELMNAMCHR1
SCHEMBL5577872 0.89 MEN1 (0.49) SIGMAR1KDM4EMCHR1CACNA1GCHRM4
SCHEMBL5577574 0.89 GAA (0.44) SIGMAR1GAAKDM4ELMNAMCHR1
SCHEMBL5577647 0.88 CACNA1G (0.48) SIGMAR1GAAKDM4ELMNAMCHR1
SCHEMBL5577713 0.88 GAA (0.46) SIGMAR1GAAKDM4ELMNA
SCHEMBL5577712 0.88 GAA (0.57) SIGMAR1GAAKDM4ELMNAMCHR1
SCHEMBL5577338 0.88 SIGMAR1 (0.43) SIGMAR1GAAKDM4ELMNAMCHR1

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 SIGMAR1 3281/4885GAA 3806/4885KDM4E 4213/4885

“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.