SCHEMBL6028084

SCHEMBL6028084

NC(=O)c1cccc2cc(-c3ccc4ccccc4c3)[nH]c12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.59
PDPK1 O15530 1/20 0.49
HDAC11 Q96DB2 1/20 0.47
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
CDC7 O00311 2/20 0.46
GAA P10253 1/20 0.46
IKBKB O14920 4/20 0.46
CHUK O15111 3/20 0.46
PTGER3 P43115 2/20 0.43
PLK4 O00444 1/20 0.43
CHEK1 O14757 1/20 0.43
AURKA O14965 1/20 0.43
DAPK3 O43293 1/20 0.43
MAP4K4 O95819 1/20 0.43
CSF1R P07333 1/20 0.43
RET P07949 1/20 0.43
FGFR1 P11362 1/20 0.43
PDGFRA P16234 1/20 0.43
LTK P29376 1/20 0.43

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
SCHEMBL6029606 0.87 DHODH (0.78) DHODHPDPK1HDAC11ALDH1A1KDM4E
SCHEMBL6029671 0.86 DHODH (0.68) DHODHPDPK1HDAC11ALDH1A1KDM4E
SCHEMBL6028044 0.84 DHODH (0.61) DHODHPDPK1HDAC11ALDH1A1KDM4E
SCHEMBL6028892 0.83 DHODH (0.59) DHODHPDPK1HDAC11ALDH1A1KDM4E
SCHEMBL6028389 0.83 DHODH (0.59) DHODHPDPK1HDAC11CDC7PLK4
SCHEMBL6028357 0.83 DHODH (0.59) DHODHPDPK1HDAC11CDC7IKBKB
SCHEMBL6028632 0.83 DHODH (0.56) DHODHPDPK1HDAC11ALDH1A1KDM4E
SCHEMBL6029396 0.83 PDPK1 (0.54) DHODHPDPK1HDAC11IKBKBCHUK
SCHEMBL6027913 0.82 DHODH (0.56) DHODHPDPK1HDAC11CDC7PLK4
SCHEMBL6029194 0.82 CDC7 (0.57) DHODHPDPK1HDAC11KDM4ECDC7

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-7087637-B2 Substituted indoles which are PARP inhibitors BASF AG (DE) 2006-08-08 US disclosed
US-20040067949-A1 Substituted indoles which are parp inhibitors ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2004-04-08 US 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-20040067949-A1 Substituted indoles which are parp inhibitors PARP1, PARP2, PARP12 DHODH 674/4885PDPK1 235/4885HDAC11 1186/4885

“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.