SCHEMBL6702367

SCHEMBL6702367

O=C(Nc1cc(C(=O)N2CCNCC2)ccc1N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1)NC1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 12/20 0.43
BAK1 Q16611 9/20 0.43
ACKR3 P25106 1/20 0.42
MLNR O43193 3/20 0.42
HTR7 P34969 1/20 0.41
BCL2L1 Q07817 5/20 0.40
EPHX2 P34913 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
GAA P10253 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
SCHEMBL6701837 0.87 BCL2 (0.46) BCL2BAK1HTR7BCL2L1KDM4E
SCHEMBL6698106 0.86 ALDH1A1 (0.46) KDM4EMAPTGAA
SCHEMBL6702360 0.81 HTT (0.48) GAA
SCHEMBL6699144 0.78 GAA (0.48) KDM4EMAPTGAA
SCHEMBL6696311 0.77 HTT (0.52) KDM4EMAPTGAA
SCHEMBL6697460 0.77 TP53 (0.48) KDM4EMAPT
SCHEMBL6700073 0.76 HTT (0.51) KDM4EMAPTGAA
SCHEMBL6698133 0.76 GAA (0.47) ACKR3KDM4EMAPTGAA
SCHEMBL6699722 0.75 HTT (0.50) KDM4EMAPTGAA
SCHEMBL6688584 0.75 BCL2 (0.43) BCL2BAK1HTR7BCL2L1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040235855-A1 Phospholipase C inhibitors for use in treating inflammatory disorders JANSSEN PHARMACEUTICA, N.V. (BE) 2004-11-25 US claimed

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-20040235855-A1 Phospholipase C inhibitors for use in treating inflammatory disorders PLA2G4C, PLA2G4B, PLA2G5 BCL2 1870/4885BAK1 691/4885ACKR3 630/4885

“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.