SCHEMBL4864978

SCHEMBL4864978

CN(C)c1cccc(NC(N)=O)c1.Cc1cccc(N(C)C(=O)NN)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
HSP90AA1 P07900 1/20 0.45
KCNK3 O14649 1/20 0.45
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 2/20 0.43
GAA P10253 1/20 0.43
ALOX15 P16050 1/20 0.43
KDR P35968 2/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
HSD17B1 P14061 1/20 0.41
HSD17B2 P37059 1/20 0.41
CYP1A2 P05177 1/20 0.40

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
SCHEMBL14816267 0.84 HSD17B1 (0.52) MEN1KMT2AHSP90AA1SMN1; SMN2KDR
SCHEMBL33898 0.83 MAPT (0.57) MEN1KMT2AKCNK3MAPTSMN1; SMN2
SCHEMBL29356607 0.83 MAPT (0.57) MEN1KMT2AKCNK3MAPTSMN1; SMN2
SCHEMBL28877258 0.76 ALDH1A1 (0.57) MEN1KMT2AKCNK3MAPTSMN1; SMN2
SCHEMBL24166779 0.76 MEN1 (0.46) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL16518668 0.76 HSD17B10 (0.57) MEN1KMT2AHSP90AA1KCNK3SMN1; SMN2
SCHEMBL166848 0.75 HSD17B10 (0.69) MEN1KMT2AKCNK3SMN1; SMN2ALDH1A1
SCHEMBL10212285 0.74 KDR (0.57) MEN1KMT2AHSP90AA1KCNK3SMN1; SMN2
Hydrochloric Acid SCHEMBL8884354 0.73 HSD17B10 (0.67) MEN1KMT2AKCNK3SMN1; SMN2ALDH1A1
Benzene SCHEMBL15881255 0.73 HSD17B10 (0.67) MEN1KMT2AKCNK3SMN1; SMN2ALDH1A1

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-7431742-B2 Hair coloring kits and methods of use thereof THE PROCTER & GAMBLE COMPANY (US) 2008-10-07 US disclosed
US-20070251025-A1 Hair coloring kits and methods of use thereof THE PROCTER & GAMBLE COMPANY 2007-11-01 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-20070251025-A1 Hair coloring kits and methods of use thereof COXFA4L2, SQOR, GPX4 MEN1 3903/4885KMT2A 2656/4885HSP90AA1 3491/4885

“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.