SCHEMBL17774931

SCHEMBL17774931

CCNC(=O)CN(CC)c1ccc(N)c(C(N)=O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.42
▸ ALDH1A1 P00352 6/20 0.42
▸ MEN1 O00255 5/20 0.42
▸ KMT2A Q03164 5/20 0.42
▸ HPGD P15428 4/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ ATM Q13315 2/20 0.42
▸ S100B P04271 1/20 0.42
▸ GAA P10253 2/20 0.41
▸ PDK2 Q15119 1/20 0.40
▸ KDM4E B2RXH2 3/20 0.37
▸ GFER P55789 2/20 0.37
▸ GLA P06280 1/20 0.37
▸ NOS2 P35228 1/20 0.37
▸ IKBKB O14920 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ OXTR P30559 1/20 0.37
▸ AVPR1A P37288 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ AOC3 Q16853 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
SCHEMBL19788667 0.88 MAPT (0.43) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL17774966 0.85 S100B (0.56) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL17774939 0.82 MAPT (0.43) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL17774952 0.80 S100B (0.46) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL17774929 0.79 S100B (0.45) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL17774935 0.77 IKBKB (0.42) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL17774950 0.75 IKBKB (0.44) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL11545057 0.73 S100B (0.56) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL17774973 0.72 IKBKB (0.39) MAPTALDH1A1MEN1KMT2AHPGD
SCHEMBL17774924 0.72 IKBKB (0.44) MAPTALDH1A1MEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9872822-B2 Process for dyeing in the presence of oxidation bases comprising at least one sulfonic, sulfonamide, sulfone, amid or acid group and a metal catalyst, device and ready-to-use composition L'OREAL (FR) 2018-01-23 — — US disclosed
US-20160143826-A1 PROCESS FOR DYEING IN THE PRESENCE OF OXIDATION BASES COMPRISING AT LEAST ONE SULFONIC, SULFONAMIDE, SULFONE, AMID OR ACID GROUP AND A METAL CATALYST, DEVICE AND READY-TO-USE COMPOSITION L'OREAL (FR) 2016-05-26 — — US disclosed
US-20160143826-A1 PROCESS FOR DYEING IN THE PRESENCE OF OXIDATION BASES COMPRISING AT LEAST ONE SULFONIC, SULFONAMIDE, SULFONE, AMID OR ACID GROUP AND A METAL CATALYST, DEVICE AND READY-TO-USE COMPOSITION L'OREAL (FR) 2016-05-26 — — 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-20160143826-A1 PROCESS FOR DYEING IN THE PRESENCE OF OXIDATION BASES COMPRISING AT LEAST ONE SULFONIC, SULFONAMIDE, SULFONE, AMID OR ACID GROUP AND A METAL CATALYST, DEVICE AND READY-TO-USE COMPOSITION KRT18, ARSA, SQOR MAPT 2197/4885ALDH1A1 440/4885MEN1 4240/4885

“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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