SCHEMBL4958862

SCHEMBL4958862

Oc1c(C2CCCCCC2)cccc1C1CCCCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN5 P54829 4/20 0.46
PTPN2 P17706 1/20 0.46
FEN1 P39748 4/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.43
CEL P19835 2/20 0.41
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NUDT1 P36639 1/20 0.41
BACE1 P56817 1/20 0.41
HSP90AA1 P07900 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
ALOX5AP P20292 3/20 0.40
KMO O15229 1/20 0.40
PTGS2 P35354 1/20 0.39
HTR1A P08908 1/20 0.39
HTR7 P34969 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
SCHEMBL4958978 1.00 PTPN5 (0.46) PTPN5PTPN2FEN1PTGDR2CEL
SCHEMBL201425 1.00 PTPN5 (0.46) PTPN5PTPN2FEN1PTGDR2CEL
SCHEMBL4960398 1.00 PTPN5 (0.46) PTPN5PTPN2FEN1PTGDR2CEL
SCHEMBL4959318 1.00 PTPN5 (0.46) PTPN5PTPN2FEN1PTGDR2CEL
SCHEMBL4960831 0.98 PTPN5 (0.44) PTPN5PTPN2FEN1PTGDR2CEL
SCHEMBL4962594 0.93 FEN1 (0.45) PTPN5PTPN2FEN1PTGDR2HDAC4
SCHEMBL1053897 0.89 HDAC4 (0.46) PTPN5PTPN2FEN1PTGDR2CEL
SCHEMBL21626185 0.89 PTPN5 (0.52) PTPN5PTPN2FEN1PTGDR2CEL
SCHEMBL2048750 0.87 NOTUM (0.38) PTPN5PTPN2FEN1ALOX5AP
SCHEMBL1866340 0.86 HDAC4 (0.47) PTPN5PTPN2FEN1PTGDR2HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015013456-A1 INDICATOR COMPOUNDS, POLYMERIZABLE DERIVATIVES THEREOF AND INFECTION INDICATING MEDICAL DEVICES COMPRISING THE SAME INDICATOR SYSTEMS INTERNATIONAL, INC. (US) 2015-01-29 WO disclosed
EP-1871844-B1 BUBBLE COMPOSITION WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2014-08-27 EP disclosed
EP-1871844-A2 NOVELTY COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C Technologies LLC (US) 2008-01-02 EP disclosed
WO-2007008389-A2 USE OF COLOR CHANGING INDICATORS IN CONSUMER PRODUCTS C2C TECHNOLOGIES LLC (US) 2007-01-18 WO disclosed
US-20070010400-A1 Use of color changing indicators in consumer products C2C TECHNOLOGIES, LLC 2007-01-11 US disclosed
US-20060257439-A1 Cleansing compositions with color changing indicator CRAYOLA LLC 2006-11-16 US disclosed
US-20060236470-A1 Novelty compositions with color changing indicator CRAYOLA LLC 2006-10-26 US disclosed
WO-2006105193-A2 PERSONAL CARE COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2006-10-05 WO disclosed
WO-2006105260-A1 ORAL CARE COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2006-10-05 WO disclosed
WO-2006105261-A1 CLEANSING COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2006-10-05 WO disclosed
WO-2006105191-A2 NOVELTY COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2006-10-05 WO disclosed
US-20060222601-A1 Oral care compositions with color changing indicator C2C TECHNOLOGIES, LLC 2006-10-05 US disclosed
US-20060222675-A1 Personal care compositions with color changing indicator C2C TECHNOLOGIES, LLC 2006-10-05 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 (5 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-20060222675-A1 Personal care compositions with color changing indicator CUTA, POLR1C, TYR PTPN5 682/4885PTPN2 974/4885FEN1 2820/4885
US-20060257439-A1 Cleansing compositions with color changing indicator WASHC5, WASHC4, FHIT PTPN5 578/4885PTPN2 303/4885FEN1 251/4885
US-20060222601-A1 Oral care compositions with color changing indicator CA9, CA7, TAS2R7 PTPN5 4367/4885PTPN2 4419/4885FEN1 1267/4885
US-20070010400-A1 Use of color changing indicators in consumer products NQO2, CA4, CA7 PTPN5 847/4885PTPN2 1034/4885FEN1 4059/4885
US-20060236470-A1 Novelty compositions with color changing indicator MITF, CRABP2, SHH PTPN5 4276/4885PTPN2 4445/4885FEN1 1161/4885

“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.