SCHEMBL6693686

SCHEMBL6693686

CC(C)NC(=O)Nc1cc(C(=O)N2CCNCC2)ccc1N1CCN(C(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.49
ALDH1A1 P00352 5/20 0.49
HPGD P15428 2/20 0.49
OPRD1 P41143 8/20 0.46
MAOB P27338 1/20 0.45
MAPT P10636 2/20 0.44
MAPK1 P28482 1/20 0.44
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.42
OPRM1 P35372 1/20 0.42

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
SCHEMBL6699164 0.94 KMT2A (0.47) KMT2AALDH1A1HPGDOPRD1MAOB
SCHEMBL6701730 0.89 KMT2A (0.48) KMT2AALDH1A1HPGDOPRD1MAOB
SCHEMBL6700031 0.88 KMT2A (0.46) KMT2AALDH1A1HPGDOPRD1MAOB
SCHEMBL6698658 0.88 KMT2A (0.50) KMT2AALDH1A1HPGDOPRD1MAOB
SCHEMBL6700073 0.87 HTT (0.51) KMT2AALDH1A1HPGDOPRD1MAOB
SCHEMBL6701311 0.87 KMT2A (0.45) KMT2AALDH1A1HPGDOPRD1MAOB
SCHEMBL6696335 0.86 ALDH1A1 (0.49) KMT2AALDH1A1HPGDOPRD1MAOB
SCHEMBL5568497 0.86 OPRD1 (0.49) KMT2AALDH1A1HPGDOPRD1MAOB
SCHEMBL29968772 0.86 OPRD1 (0.49) KMT2AALDH1A1HPGDOPRD1MAOB
SCHEMBL6696311 0.86 HTT (0.52) KMT2AALDH1A1HPGDOPRD1MAOB

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 KMT2A 4455/4885ALDH1A1 1583/4885HPGD 1196/4885

“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.