SCHEMBL578294

SCHEMBL578294

CC(O)n1nc(N)cc1N

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 2/20 0.32
NOS3 P29474 1/20 0.32
NOS1 P29475 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
SCHEMBL11747616 0.81 POLB (0.41)
SCHEMBL30475235 0.81 PIK3CG (0.36) NOS2NOS3NOS1
SCHEMBL29404589 0.74
SCHEMBL11469821 0.67 NOS3 (0.38) NOS2NOS3NOS1
SCHEMBL2817008 0.67 PIK3CG (0.38) NOS2NOS3NOS1
SCHEMBL4555339 0.65 RET (0.30)
SCHEMBL11687312 0.65 POLB (0.43)
SCHEMBL14321149 0.65 IKBKB (0.33)
SCHEMBL1498842 0.65 IKBKB (0.33)
SCHEMBL19992372 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2658513-B2 HAIR COLOURING COMPOSITION KAO GERMANY GMBH (DE) 2023-11-29 EP disclosed
EP-2939656-B1 AQUEOUS OXIDATIVE DYEING COMPOSITION KAO GERMANY GMBH (DE) 2020-09-23 EP disclosed
EP-2658513-B1 HAIR COLOURING COMPOSITION KAO GERMANY GMBH (DE) 2019-03-20 EP disclosed
EP-2658509-B1 HAIR COLOURING COMPOSITION COMPRISING GLUCONIC ACID AND/OR ITS SALTS KAO GERMANY GMBH (DE) 2018-05-16 EP disclosed
EP-2939656-A1 AQUEOUS OXIDATIVE DYEING COMPOSITION Kao Germany GmbH (DE) 2015-11-04 EP disclosed
US-8636813-B2 Hair colouring composition Kao Germany (DE) 2014-01-28 US disclosed
US-20130298936-A1 HAIR COLOURING COMPOSITION KAO GERMANY GMBH (DE) 2013-11-14 US disclosed
EP-2658509-A2 HAIR COLOURING COMPOSITION Kao Germany GmbH (DE) 2013-11-06 EP disclosed
EP-2658513-A2 HAIR COLOURING COMPOSITION Kao Germany GmbH (DE) 2013-11-06 EP disclosed
US-20130287719-A1 HAIR COLOURING COMPOSITION KAO GERMANY GMBH (DE) 2013-10-31 US disclosed
WO-2012089673-A2 HAIR COLOURING COMPOSITION KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2012-07-05 WO disclosed
WO-2012089681-A2 HAIR COLOURING COMPOSITION KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2012-07-05 WO disclosed
EP-2471503-A1 Hair colouring composition comprising a polyhydroxy carboxylic acid KPSS-Kao Professional Salon Services GmbH (DE) 2012-07-04 EP disclosed
EP-2417965-A1 Hair colouring composition KPSS-Kao Professional Salon Services GmbH (DE) 2012-02-15 EP 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-20130287719-A1 HAIR COLOURING COMPOSITION FECH, PLOD2, HAAO NOS2 1381/4885NOS3 1740/4885NOS1 1433/4885
US-20130298936-A1 HAIR COLOURING COMPOSITION TYR, SHH, S100P NOS2 2333/4885NOS3 2494/4885NOS1 2377/4885

“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.