SCHEMBL16569986

SCHEMBL16569986

CCCN(CCC)C(=O)c1ccnc(C(=O)N(CCC)CCC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
MAPT P10636 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
HPGD P15428 4/20 0.49
MLYCD O95822 1/20 0.46
TP53 P04637 1/20 0.46
EGFR P00533 1/20 0.44
ERBB2 P04626 1/20 0.44
KDM4E B2RXH2 3/20 0.43
KDM5A P29375 2/20 0.43
KDM5C P41229 2/20 0.43
KDM5B Q9UGL1 2/20 0.43
KDM6B O15054 1/20 0.43
TET3 O43151 1/20 0.43
KDM4A O75164 1/20 0.43
BBOX1 O75936 1/20 0.43
ASPH Q12797 1/20 0.43
KDM4D Q6B0I6 1/20 0.43
TET2 Q6N021 1/20 0.43
ALKBH5 Q6P6C2 1/20 0.43

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
SCHEMBL3857943 0.91 ALDH1A1 (0.57) ALDH1A1MAPTL3MBTL1HPGDMLYCD
SCHEMBL3854386 0.91 KDM5B (0.57) ALDH1A1MAPTL3MBTL1TP53KDM4E
SCHEMBL3807628 0.89 ALDH1A1 (0.49) ALDH1A1MAPTL3MBTL1HPGDMLYCD
SCHEMBL5808527 0.87 ALDH1A1 (0.69) ALDH1A1MAPTL3MBTL1HPGDMLYCD
SCHEMBL5156043 0.83 ALDH1A1 (0.49) ALDH1A1MAPTL3MBTL1HPGDMLYCD
SCHEMBL18864231 0.83 MAPT (0.46) ALDH1A1MAPTL3MBTL1HPGDMLYCD
SCHEMBL6239726 0.83 ALDH1A1 (0.46) ALDH1A1MAPTL3MBTL1KDM4EKDM5A
SCHEMBL3854935 0.83 ALDH1A1 (0.77) ALDH1A1MAPTL3MBTL1HPGDMLYCD
SCHEMBL3853630 0.83 HPGD (0.48) ALDH1A1MAPTL3MBTL1HPGDMLYCD
SCHEMBL6985934 0.80 MAPT (0.43) ALDH1A1MAPTL3MBTL1HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11045407-B2 Process for treating keratin fibres with a pyridinedicarboxylic acid compound L'OREAL (FR) 2021-06-29 US disclosed
US-10857087-B2 Process for treating keratin fibres with a polysaccharide and a pyridinedi-carboxylic acid compound L'OREAL (FR) 2020-12-08 US disclosed
EP-3110394-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A PYRIDINEDICARBOXYLIC ACID COMPOUND L'Oréal (FR) 2017-01-04 EP disclosed
EP-3107525-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A POLYSACCHARIDE AND A PYRIDINEDI-CARBOXYLIC ACID COMPOUND L'Oréal (FR) 2016-12-28 EP disclosed
US-20160228346-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A POLYSACCHARIDE AND A PYRIDINEDI-CARBOXYLIC ACID COMPOUND L'OREAL (FR) 2016-08-11 US disclosed
US-20160213587-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A PYRIDINEDICARBOXYLIC ACID COMPOUND L'OREAL (FR) 2016-07-28 US disclosed
WO-2015036477-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A PYRIDINEDICARBOXYLIC ACID COMPOUND L'OREAL (FR) 2015-03-19 WO disclosed
WO-2015036476-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A POLYSACCHARIDE AND A PYRIDINEDI-CARBOXYLIC ACID COMPOUND L'OREAL (FR) 2015-03-19 WO 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 (4 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-11045407-B2 Process for treating keratin fibres with a pyridinedicarboxylic acid compound KRT18, CUTA, HKDC1 ALDH1A1 1282/4885MAPT 361/4885L3MBTL1 4850/4885
US-20160228346-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A POLYSACCHARIDE AND A PYRIDINEDI-CARBOXYLIC ACID COMPOUND KRT18, HKDC1, PHYKPL ALDH1A1 463/4885MAPT 900/4885L3MBTL1 4883/4885
US-20160213587-A1 PROCESS FOR TREATING KERATIN FIBRES WITH A PYRIDINEDICARBOXYLIC ACID COMPOUND KRT18, CUTA, HKDC1 ALDH1A1 1282/4885MAPT 361/4885L3MBTL1 4850/4885
US-10857087-B2 Process for treating keratin fibres with a polysaccharide and a pyridinedi-carboxylic acid compound KRT18, HKDC1, PHYKPL ALDH1A1 463/4885MAPT 900/4885L3MBTL1 4883/4885

“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.