SCHEMBL6703117

SCHEMBL6703117

CC(c1ccccc1)N1CCN(c2ccc(C(=O)N3CCNCC3)cc2NC(=O)Nc2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 4/20 0.47
KMT2A Q03164 4/20 0.47
HPGD P15428 2/20 0.47
TP53 P04637 2/20 0.47
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.45
CCNC P24863 7/20 0.44
CDK8 P49336 7/20 0.44
NPY2R P49146 1/20 0.43
MAPK1 P28482 1/20 0.42
EPHX2 P34913 1/20 0.42
GAA P10253 1/20 0.41

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
SCHEMBL6701730 0.91 KMT2A (0.48) MAPTKDM4EALDH1A1KMT2AHPGD
SCHEMBL6698658 0.88 KMT2A (0.50) MAPTKDM4EALDH1A1KMT2AHPGD
SCHEMBL6698133 0.86 GAA (0.47) MAPTKDM4EALDH1A1KMT2AHPGD
SCHEMBL6701834 0.86 TSHR (0.47) MAPTKDM4EALDH1A1KMT2AHPGD
SCHEMBL6701311 0.85 KMT2A (0.45) MAPTKDM4EALDH1A1KMT2AHPGD
SCHEMBL6701774 0.85 KDM4E (0.47) MAPTKDM4EALDH1A1KMT2AHPGD
SCHEMBL6702347 0.85 OPRD1 (0.44) MAPTKDM4EALDH1A1KMT2AHPGD
SCHEMBL6701825 0.85 USP2 (0.50) MAPTKDM4EALDH1A1KMT2AHPGD
SCHEMBL6693686 0.84 KMT2A (0.49) MAPTALDH1A1KMT2AHPGDMAPK1
SCHEMBL6699164 0.84 KMT2A (0.47) MAPTKDM4EALDH1A1KMT2AHPGD

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 MAPT 4701/4885KDM4E 3920/4885ALDH1A1 1583/4885

“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.