SCHEMBL12848263

SCHEMBL12848263

CCNC(=O)c1cc2cc(N)ccc2[nH]1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.58
HDAC2 Q92769 1/20 0.54
KDM4E B2RXH2 5/20 0.53
HRH4 Q9H3N8 2/20 0.51
ALDH1A1 P00352 2/20 0.51
MAPT P10636 1/20 0.51
DRD2 P14416 1/20 0.50
DRD3 P35462 1/20 0.50
HRH3 Q9Y5N1 1/20 0.49
GAA P10253 1/20 0.48
MAPK1 P28482 1/20 0.48
PYGL P06737 1/20 0.47
SRC P12931 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CYP2A6 P11509 1/20 0.46
KEAP1 Q14145 1/20 0.46
NHERF1 O14745 1/20 0.46
HTR2C P28335 1/20 0.46

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
SCHEMBL1415238 0.89 KDM4E (0.61) ALOX15HDAC2KDM4EHRH4ALDH1A1
SCHEMBL13753366 0.84 RAB9A (0.62) ALOX15HDAC2KDM4EHRH4ALDH1A1
SCHEMBL13753882 0.84 SRC (0.65) ALOX15KDM4EHRH4ALDH1A1MAPT
SCHEMBL12501351 0.83 ALOX15 (0.55) ALOX15HDAC2KDM4EHRH4ALDH1A1
SCHEMBL13753364 0.82 CNR1 (0.62) ALOX15HDAC2KDM4EHRH4ALDH1A1
SCHEMBL13753365 0.82 ALOX15 (0.79) ALOX15HRH4HRH3PYGLNHERF1
SCHEMBL15224031 0.80 HRH4 (0.55) HDAC2KDM4EHRH4ALDH1A1HRH3
SCHEMBL9397179 0.80 DRD2 (0.74) ALOX15HDAC2KDM4EALDH1A1DRD2
SCHEMBL13753883 0.80 KDM4E (0.77) HDAC2KDM4EALDH1A1MAPT
SCHEMBL19901352 0.79 HRH4 (0.51) HDAC2KDM4EHRH4ALDH1A1HRH3

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-20110065767-A1 Substituted CC-1065 Analogs and Their Conjugates SYNTARGA B.V. (NL) 2011-03-17 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-20110065767-A1 Substituted CC-1065 Analogs and Their Conjugates PCNA, TOP1, TOP2B ALOX15 2925/4885HDAC2 3002/4885KDM4E 752/4885

“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.