SCHEMBL5382173

SCHEMBL5382173

CCOC(OCC)c1ccc(N(C)C)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.39
MEN1 O00255 5/20 0.39
HSD17B10 Q99714 2/20 0.35
MAPT P10636 1/20 0.34
ELANE P08246 1/20 0.34
FFAR1 O14842 1/20 0.34
TSHR P16473 2/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
ATM Q13315 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
BACE1 P56817 2/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
ALDH1A1 P00352 2/20 0.32
ALOX15 P16050 1/20 0.32
TERT O14746 1/20 0.32
APP P05067 1/20 0.32

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
SCHEMBL5388771 0.81 CRHR1 (0.38) KMT2AMEN1HSD17B10MAPTELANE
SCHEMBL5389460 0.80 PTGS1 (0.38) KMT2AMEN1MAPTELANETSHR
SCHEMBL5385026 0.79 PDE4A (0.40) KMT2AMEN1HSD17B10TSHRLMNA
SCHEMBL5555851 0.76 KMT2A (0.47) KMT2AMEN1HSD17B10MAPTTSHR
SCHEMBL11726550 0.76 ESR1 (0.52) KMT2AMEN1HSD17B10MAPTFFAR1
SCHEMBL10349015 0.73 KMT2A (0.40) KMT2AMEN1HSD17B10MAPTTSHR
SCHEMBL5388824 0.71 GAA (0.49) KMT2AMEN1HSD17B10TSHRNPC1
SCHEMBL6155730 0.71 CASP1 (0.45) MAPTTSHRLMNAATM
SCHEMBL8777683 0.70 SLC2A1 (0.39) KMT2AMEN1HSD17B10MAPTTSHR
SCHEMBL11595408 0.69 MAPT (0.51) KMT2AMEN1HSD17B10MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7300472-B2 Agents for coloring fibers containing keratin HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-11-27 US disclosed
US-20070000074-A1 Agents for coloring fibers containing keratin HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2007-01-04 US disclosed
EP-1534227-B1 AGENTS USED FOR DYEING KERATINOUS FIBERS HENKEL KGAA (DE) 2006-12-27 EP disclosed
US-7105032-B2 Agents used for dyeing keratinous fibers HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2006-09-12 US disclosed
US-20050144740-A1 Agents used for dyeing keratinous fibers HENKEL AG & CO. KGAA (DE) 2005-07-07 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 (2 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-20050144740-A1 Agents used for dyeing keratinous fibers KRT18, TUBB3, DSG1 KMT2A 1260/4885MEN1 4420/4885HSD17B10 1319/4885
US-20070000074-A1 Agents for coloring fibers containing keratin KRT18, COL1A1, CYC1 KMT2A 1075/4885MEN1 2301/4885HSD17B10 2392/4885

“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.