SCHEMBL11235250

SCHEMBL11235250

CC(C)=CC(=O)CC(C)(C)N=O

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.30
STAT3 P40763 1/20 0.30

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
SCHEMBL9004549 0.77 STAT3 (0.33) PTPN1STAT3
SCHEMBL11234652 0.74
SCHEMBL24535254 0.70 PTPN1 (0.30) PTPN1STAT3
SCHEMBL13877935 0.70 ALOX15 (0.32) PTPN1STAT3
SCHEMBL28568122 0.68 PTPN1 (0.46) PTPN1STAT3
SCHEMBL28142580 0.67
SCHEMBL12630695 0.67 KMT2A (0.31)
SCHEMBL13039627 0.65 ALDH1A1 (0.39) PTPN1STAT3
SCHEMBL9004553 0.64 STAT3 (0.32) STAT3
SCHEMBL18737370 0.63 MEN1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4363333-A NITRIC OXIDE FILTER COMPRISING NITROSO COMPOUND ADSORBED ON ACTIVATED CARBON BRITISH-AMERICAN TOBACCO COMPANY LIMITED (GB) 1982-12-14 US disclosed