SCHEMBL4960629

SCHEMBL4960629

O=C(OC(=O)c1cccc2cc(F)ccc12)c1cccc2cc(F)ccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.45
GAA P10253 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 1/20 0.44
CYP1A2 P05177 1/20 0.39
CYP2A6 P11509 1/20 0.39
NR4A1 P22736 1/20 0.39
NR4A2 P43354 1/20 0.39
NR4A3 Q92570 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
IDO1 P14902 1/20 0.38
CNR1 P21554 2/20 0.38
CNR2 P34972 2/20 0.38
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
FLT3 P36888 1/20 0.36
TSHR P16473 1/20 0.36
CES2 O00748 3/20 0.36
CES1 P23141 3/20 0.36

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
SCHEMBL4960266 0.86 KMT2A (0.44) GAAKMT2APOLBCYP1A2CYP2A6
SCHEMBL4957630 0.82 KDM4E (0.41) PTPN1GAAKMT2APOLBCYP1A2
SCHEMBL30369504 0.82 PTPN1 (0.66) PTPN1GAAKMT2ACYP1A2CYP2A6
SCHEMBL4104113 0.82 PTPN1 (0.66) PTPN1GAAKMT2ACYP1A2CYP2A6
SCHEMBL9654305 0.81 PTPN1 (0.46) PTPN1GAAKMT2ACYP1A2CYP2A6
SCHEMBL4097322 0.80 CNR2 (0.44) PTPN1KMT2APOLBCYP1A2CYP2A6
SCHEMBL4962003 0.79 KMT2A (0.47) PTPN1GAAKMT2APOLBCYP2A6
SCHEMBL4960252 0.79 PTPN1 (0.45) PTPN1GAAKMT2APOLBNR4A1
SCHEMBL4961105 0.79 PTPN1 (0.45) PTPN1GAAKMT2APOLBCYP2A6
SCHEMBL17288414 0.78 CYP1A2 (0.45) PTPN1GAACYP1A2CYP2A6NR4A1

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 PTPN1 940/4885GAA 797/4885KMT2A 3653/4885
US-20060257439-A1 Cleansing compositions with color changing indicator WASHC5, WASHC4, FHIT PTPN1 663/4885GAA 234/4885KMT2A 3047/4885
US-20060222601-A1 Oral care compositions with color changing indicator CA9, CA7, TAS2R7 PTPN1 4174/4885GAA 721/4885KMT2A 2738/4885
US-20070010400-A1 Use of color changing indicators in consumer products NQO2, CA4, CA7 PTPN1 1330/4885GAA 14/4885KMT2A 1465/4885
US-20060236470-A1 Novelty compositions with color changing indicator MITF, CRABP2, SHH PTPN1 4466/4885GAA 1361/4885KMT2A 1508/4885

“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.