SCHEMBL5577419

SCHEMBL5577419

COc1ccc(CN2CCN(c3ncccc3CNC(=O)c3cccc(Cl)c3C)C(C)C2)cc1OC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
S1PR1 P21453 2/20 0.43
S1PR5 Q9H228 2/20 0.43
TP53 P04637 2/20 0.41
HPGD P15428 2/20 0.40
MALT1 Q9UDY8 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
DRD2 P14416 2/20 0.40
DRD4 P21917 2/20 0.40
DRD3 P35462 2/20 0.40
TMEM97 Q5BJF2 2/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
MAPK8 P45983 2/20 0.39
HCRTR1 O43613 1/20 0.39
HCRTR2 O43614 1/20 0.39
EPHX2 P34913 1/20 0.38

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
SCHEMBL5577655 0.88 S1PR1 (0.45) LMNAS1PR1S1PR5HPGDKDM4E
SCHEMBL5577621 0.88 LMNA (0.47) LMNAS1PR1S1PR5TP53MALT1
SCHEMBL5577376 0.88 MAPK8 (0.43) TP53KMT2AMEN1MAPK8
SCHEMBL5577347 0.87 GAA (0.46) LMNAS1PR1S1PR5ALDH1A1DRD2
SCHEMBL5577384 0.86 ALDH1A1 (0.41) LMNAS1PR1S1PR5HPGDKDM4E
SCHEMBL5577674 0.86 LMNA (0.44) LMNAS1PR1S1PR5HPGDKDM4E
SCHEMBL5577549 0.86 LMNA (0.48) LMNAS1PR1S1PR5HPGDKDM4E
SCHEMBL5577387 0.85 LMNA (0.43) LMNAS1PR1S1PR5TP53HPGD
SCHEMBL5577253 0.85 P2RX7 (0.44) LMNATP53MALT1KDM4EALDH1A1
SCHEMBL5577605 0.84 LMNA (0.45) LMNAS1PR1S1PR5TP53DRD2

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 LMNA 4819/4885S1PR1 1242/4885S1PR5 1475/4885

“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.