SCHEMBL13525192

SCHEMBL13525192

COc1cc(N(C)C)ccc1N=C1C=C(C)C(=O)C(C)=C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ GAA P10253 2/20 0.40
▸ PKM P14618 1/20 0.40
▸ MAPT P10636 4/20 0.39
▸ LMNA P02545 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ EP300 Q09472 1/20 0.38
▸ KAT2A Q92830 1/20 0.38
▸ KAT2B Q92831 1/20 0.38
▸ RBBP9 O75884 1/20 0.37
▸ TUBB4A P04350 1/20 0.35
▸ TUBB P07437 1/20 0.35
▸ TUBA3C P0DPH7 1/20 0.35

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
SCHEMBL13525183 0.82 MAPT (0.38) MEN1KMT2AALDH1A1GAAPKM
SCHEMBL11321315 0.81 PABPC1 (0.40) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL13525223 0.80 KDM4E (0.36) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL11306628 0.76 KDM4E (0.37) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL13525228 0.76 ALDH1A1 (0.37) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL11308395 0.75 SMN1; SMN2 (0.34) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL11309184 0.74 ALDH1A1 (0.44) MEN1KMT2AALDH1A1GAAMAPT
Hydrochloric Acid SCHEMBL11287024 0.72 ALDH1A1 (0.42) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL11323978 0.70 MAPT (0.35) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL11312372 0.70 MAPT (0.34) MEN1KMT2AALDH1A1GAAMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7645304-B2 Dyeing of in particular human keratin materials by dry thermal transfer of a direct azomethine dye, composition comprising the said dye and its method of preparation L'OREAL S.A. (FR) 2010-01-12 — — US disclosed
US-7645304-B2 Dyeing of in particular human keratin materials by dry thermal transfer of a direct azomethine dye, composition comprising the said dye and its method of preparation L'OREAL S.A. (FR) 2010-01-12 — — US disclosed
US-20080120792-A1 Dyeing of in Particular Human Keratin Materials by Dry Thermal Transfer of a Direct Azomethine Dye, Composition Comprising the Said Dye and its Method of Preparation L'OREAL S.A. (FR) 2008-05-29 — — US disclosed
US-20080120792-A1 Dyeing of in Particular Human Keratin Materials by Dry Thermal Transfer of a Direct Azomethine Dye, Composition Comprising the Said Dye and its Method of Preparation L'OREAL S.A. (FR) 2008-05-29 — — 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-20080120792-A1 Dyeing of in Particular Human Keratin Materials by Dry Thermal Transfer of a Direct Azomethine Dye, Composition Comprising the Said Dye and its Method of Preparation KRT18, IK, KLK5 MEN1 1750/4885KMT2A 636/4885ALDH1A1 899/4885

“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.

Send feedback