SCHEMBL17779286

SCHEMBL17779286

CCOCCCNc1ccc(N)c(C(N)=O)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.40
RAB9A P51151 2/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
PTGER4 P35408 1/20 0.39
NPC1 O15118 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
BACE1 P56817 1/20 0.39
BACE2 Q9Y5Z0 1/20 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
SCHEMBL17774900 0.85 F2R (0.44) RAB9AKDM4EMEN1KMT2ABACE1
SCHEMBL17774906 0.82 ALDH1A1 (0.47) HPGDKDM4EALDH1A1MEN1KMT2A
SCHEMBL17779287 0.78 SYK (0.51) RAB9AL3MBTL1KDM4EALDH1A1
SCHEMBL17779289 0.78 JAK2 (0.40) HPGDHTTKDM4EALDH1A1SMN1; SMN2
SCHEMBL17779337 0.78 BACE1 (0.45) HPGDRAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL17779229 0.78 IKBKB (0.45) HPGDHTTKDM4EALDH1A1
SCHEMBL17779288 0.76 ALDH1A1 (0.50) HPGDRAB9AL3MBTL1KDM4EALDH1A1
SCHEMBL17779338 0.75 IKBKB (0.40) HPGDRAB9AL3MBTL1KDM4EALDH1A1
SCHEMBL14028551 0.74 ALDH1A1 (0.44) HPGDRAB9AHTTL3MBTL1KDM4E
SCHEMBL11793095 0.74 KDM4E (0.42) HPGDRAB9AL3MBTL1KDM4EALDH1A1

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 2 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

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 HPGD 588/4885RAB9A 3759/4885HTT 4143/4885

“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.