SCHEMBL17774950

SCHEMBL17774950

CCN(C)c1ccc(N)c(C(N)=O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 1/20 0.44
▸ ADRA2A P08913 1/20 0.44
▸ ADRA2B P18089 1/20 0.44
▸ ADRA2C P18825 1/20 0.44
▸ ALDH1A1 P00352 7/20 0.40
▸ MAPT P10636 6/20 0.40
▸ HPGD P15428 5/20 0.40
▸ KMT2A Q03164 4/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ ATM Q13315 1/20 0.40
▸ GAA P10253 4/20 0.39
▸ S100B P04271 1/20 0.39
▸ IGLV6-57 P01721 1/20 0.37
▸ CDC25B P30305 1/20 0.35
▸ CASP6 P55212 1/20 0.35
▸ RCE1 Q9Y256 1/20 0.35
▸ KDM4E B2RXH2 5/20 0.35
▸ HSD17B10 Q99714 4/20 0.35
▸ ALOX15 P16050 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
SCHEMBL17774956 0.87 IKBKB (0.41) IKBKBADRA2AALDH1A1MAPTHPGD
SCHEMBL17774966 0.85 S100B (0.56) IKBKBALDH1A1MAPTHPGDKMT2A
SCHEMBL17779281 0.84 MAPT (0.47) IKBKBADRA2AALDH1A1MAPTHPGD
SCHEMBL17774944 0.84 IKBKB (0.41) IKBKBALDH1A1MAPTHPGDKMT2A
SCHEMBL17774928 0.84 IKBKB (0.41) IKBKBALDH1A1MAPTHPGDKMT2A
SCHEMBL17774945 0.83 IKBKB (0.41) IKBKBALDH1A1MAPTHPGDKMT2A
SCHEMBL7675158 0.82 IKBKB (0.49) IKBKBADRA2AADRA2BADRA2CALDH1A1
SCHEMBL17774976 0.80 IKBKB (0.39) IKBKBALDH1A1MAPTHPGDGAA
SCHEMBL17774977 0.80 IGLV6-57 (0.41) IKBKBALDH1A1MAPTHPGDKMT2A
SCHEMBL17774952 0.80 S100B (0.46) IKBKBALDH1A1MAPTHPGDKMT2A

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-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-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 IKBKB 3089/4885ADRA2A 3540/4885ADRA2B 3189/4885

“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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