SCHEMBL21187004

SCHEMBL21187004

Brc1cc2c3ccccc3c3ccccc3c2c2sc3ccccc3c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.46
TNKS O95271 2/20 0.42
TNKS2 Q9H2K2 2/20 0.42
GPR3 P46089 1/20 0.40
MAPT P10636 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
RAB9A P51151 2/20 0.40
PTPRC P08575 1/20 0.37
PTPRF P10586 1/20 0.37
PTPRA P18433 1/20 0.37
PTPRB P23467 1/20 0.37
PTPN6 P29350 1/20 0.37
DUSP3 P51452 1/20 0.37
PTPN12 Q05209 1/20 0.37
ALDH1A1 P00352 5/20 0.37
HPGD P15428 2/20 0.37
HCRTR1 O43613 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL22172094 0.84 PTPN1 (0.50) PTPN1TNKSTNKS2GPR3MAPT
SCHEMBL15003463 0.79 PTPN1 (0.46) PTPN1TNKSTNKS2GPR3MAPT
SCHEMBL1295178 0.78 GPR3 (0.52) PTPN1TNKSTNKS2GPR3MAPT
SCHEMBL17689841 0.78 GPR3 (0.57) PTPN1TNKSTNKS2GPR3MAPT
SCHEMBL28091016 0.77 PTPN1 (0.48) PTPN1TNKSTNKS2GPR3MAPT
SCHEMBL1587883 0.77 PTPN1 (0.58) PTPN1TNKSTNKS2GPR3MAPT
SCHEMBL17252906 0.77 PTPN1 (0.46) PTPN1TNKSTNKS2GPR3MAPT
SCHEMBL30038579 0.77 PTPN1 (0.46) PTPN1TNKSTNKS2GPR3MAPT
SCHEMBL30885073 0.77 PTPN1 (0.46) PTPN1TNKSTNKS2GPR3MAPT
SCHEMBL19109095 0.77 TNKS (0.50) PTPN1TNKSTNKS2GPR3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10944059-B2 Compound for organic optoelectronic device, organic optoelectronic device, and display device SAMSUNG SDI CO., LTD. (KR) 2021-03-09 US disclosed
US-20190229275-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2019-07-25 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-20190229275-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OXER1, OR10J3, OCIAD1 PTPN1 978/4885TNKS 4330/4885TNKS2 4435/4885
US-10944059-B2 Compound for organic optoelectronic device, organic optoelectronic device, and display device OXER1, OR10J3, OCIAD1 PTPN1 978/4885TNKS 4330/4885TNKS2 4435/4885

“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.