SCHEMBL19628175

SCHEMBL19628175

c1ccc(-c2c3ccccc3c(-c3cc4cccc5c6c7ccccc7sc6c6cccc3c6c45)c3ccccc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.37
TNKS O95271 2/20 0.35
TNKS2 Q9H2K2 2/20 0.35
ALOX5 P09917 2/20 0.35
ESR1 P03372 3/20 0.33
ESR2 Q92731 3/20 0.33
PTPRC P08575 1/20 0.33
PTPRF P10586 1/20 0.33
PTPRA P18433 1/20 0.33
PTPRB P23467 1/20 0.33
PTPN6 P29350 1/20 0.33
DUSP3 P51452 1/20 0.33
PTPN12 Q05209 1/20 0.33
NQO1 P15559 1/20 0.33
NQO2 P16083 1/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1B1 Q16678 1/20 0.33
F9 P00740 1/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 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
SCHEMBL19628163 0.94 PTPN1 (0.38) PTPN1TNKSTNKS2ALOX5PTPRC
SCHEMBL19628140 0.89 MEN1 (0.38) PTPN1TNKSTNKS2ALOX5NQO1
SCHEMBL19628160 0.89 ALOX5 (0.35) PTPN1TNKSTNKS2ALOX5NQO1
SCHEMBL19628157 0.88 NQO1 (0.36) PTPN1TNKSTNKS2ALOX5NQO1
SCHEMBL19628170 0.88 NQO2 (0.43) PTPN1TNKSTNKS2ALOX5NQO1
SCHEMBL19628146 0.85 TNKS (0.35) PTPN1TNKSTNKS2ALOX5NQO1
SCHEMBL19628178 0.84 MEN1 (0.35) PTPN1TNKSTNKS2ALOX5NQO1
SCHEMBL17931894 0.83 PTPN1 (0.40) PTPN1TNKSTNKS2ALOX5ESR1
SCHEMBL18266972 0.83 PTPN1 (0.40) PTPN1TNKSTNKS2ALOX5ESR1
SCHEMBL19628142 0.83 ADORA2A (0.35) PTPN1TNKSTNKS2ALOX5CYP1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10439144-B2 Organic compound for electronic device comprising fused-core structure, organic optoelectronic device comprising same, and display device UNIVERSITY-INDUSTRY COOPERATEON GROUP OF KYUNG HEE UNIVERSITY (KR) 2019-10-08 US disclosed
US-20170338416-A1 ORGANIC COMPOUND FOR ELECTRONIC DEVICE COMPRISING FUSED-CORE STRUCTURE, ORGANIC OPTOELECTRONIC DEVICE COMPRISING SAME, AND DISPLAY DEVICE UNIVERSITY-INDUSTRY COOPERATION GROUP OF KYUNG HEE UNIVERSITY (KR) 2017-11-23 US disclosed
US-20170338416-A1 ORGANIC COMPOUND FOR ELECTRONIC DEVICE COMPRISING FUSED-CORE STRUCTURE, ORGANIC OPTOELECTRONIC DEVICE COMPRISING SAME, AND DISPLAY DEVICE UNIVERSITY-INDUSTRY COOPERATION GROUP OF KYUNG HEE UNIVERSITY (KR) 2017-11-23 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-10439144-B2 Organic compound for electronic device comprising fused-core structure, organic optoelectronic device comprising same, and display device OR10J3, OCIAD2, OCIAD1 PTPN1 2357/4885TNKS 4514/4885TNKS2 4597/4885
US-20170338416-A1 ORGANIC COMPOUND FOR ELECTRONIC DEVICE COMPRISING FUSED-CORE STRUCTURE, ORGANIC OPTOELECTRONIC DEVICE COMPRISING SAME, AND DISPLAY DEVICE OR10J3, OCIAD2, OCIAD1 PTPN1 2357/4885TNKS 4514/4885TNKS2 4597/4885

“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.