SCHEMBL5577828

SCHEMBL5577828

Cc1ccccc1C(=O)NCc1ccc(C2CCN(Cc3ccc(N(C)C)cc3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
KDM4E B2RXH2 2/20 0.47
CCR3 P51677 1/20 0.47
HDAC1 Q13547 3/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPK1 P28482 1/20 0.46
CCR1 P32246 2/20 0.44

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
SCHEMBL5577272 0.89 DRD2 (0.48) KDM4EHDAC1MEN1KMT2AALDH1A1
SCHEMBL5577877 0.89 ALDH1A1 (0.49) KDM4EHDAC1MEN1KMT2AALDH1A1
SCHEMBL5577280 0.87 MEN1 (0.59) KDM4EHDAC1MEN1KMT2AALDH1A1
SCHEMBL5577876 0.84 ALDH1A1 (0.65) KDM4EHDAC1MEN1KMT2AALDH1A1
SCHEMBL5577497 0.83 DRD2 (0.58) KDM4EHDAC1MEN1KMT2AALDH1A1
SCHEMBL5577413 0.82 ABCB1 (0.54) POLBCCR3
SCHEMBL5577864 0.81 ALDH1A1 (0.52) KDM4EHDAC1MEN1KMT2AALDH1A1
SCHEMBL5577352 0.80 MEN1 (0.49) HDAC1MEN1KMT2AALDH1A1
SCHEMBL5577475 0.80 TSHR (0.62) KDM4EHDAC1MEN1KMT2AALDH1A1
SCHEMBL5577696 0.79 CCR5 (0.54) KDM4EHDAC1MEN1KMT2AALDH1A1

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 POLB 3375/4885KDM4E 4213/4885CCR3 120/4885

“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.