SCHEMBL13525208

SCHEMBL13525208

CC1=CC(=Nc2ccc(N(C)C)cc2)C(N)=C(C)C1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PABPC1 P11940 1/20 0.56
▸ MEN1 O00255 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ CA12 O43570 3/20 0.42
▸ CA2 P00918 3/20 0.42
▸ CA9 Q16790 3/20 0.42
▸ POLB P06746 3/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ PTGS2 P35354 2/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ ALDH1A1 P00352 9/20 0.40
▸ MAPK1 P28482 6/20 0.40
▸ HSD17B10 Q99714 4/20 0.40
▸ TSHR P16473 4/20 0.40
▸ TP53 P04637 3/20 0.40
▸ HIF1A Q16665 1/20 0.40
▸ ALOX15 P16050 4/20 0.39
▸ TDP1 Q9NUW8 4/20 0.39

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
SCHEMBL13525222 0.84 PABPC1 (0.36) PABPC1MEN1KMT2ACA12CA2
SCHEMBL13525223 0.77 KDM4E (0.36) PABPC1MEN1KMT2AALDH1A1MAPK1
SCHEMBL13525210 0.76 PABPC1 (0.49) PABPC1MEN1KMT2ACA12CA2
SCHEMBL11309468 0.75 PABPC1 (0.67) PABPC1MEN1KMT2ACA12CA2
SCHEMBL11316017 0.75 PABPC1 (0.61) PABPC1MEN1KMT2ACA12CA2
SCHEMBL11305866 0.73 PABPC1 (0.49) PABPC1MEN1KMT2ACA12CA2
SCHEMBL11790187 0.72 PABPC1 (0.50) PABPC1MEN1KMT2ACA12CA2
SCHEMBL20280495 0.71 PABPC1 (0.69) PABPC1MEN1KMT2ACA12CA2
SCHEMBL12428488 0.71 CA2 (0.38) PABPC1MEN1KMT2ACA12CA2
SCHEMBL29423636 0.71 PABPC1 (0.69) PABPC1MEN1KMT2ACA12CA2

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 PABPC1 3727/4885MEN1 1750/4885KMT2A 636/4885

“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.

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