SCHEMBL21157145

SCHEMBL21157145

O=S1(=O)c2cnccc2-c2ccncc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.44
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
CDC25B P30305 1/20 0.40
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
RPS6KA3 P51812 1/20 0.35
SIGMAR1 Q99720 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
SIRT3 Q9NTG7 1/20 0.33
MAPT P10636 3/20 0.32
TP53 P04637 2/20 0.32
CYP3A4 P08684 2/20 0.32
CASP1 P29466 2/20 0.32
BLM P54132 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
CASP7 P55210 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL21453950 0.89 GPR3 (0.64) GPR3MAOAMAOBSMN1; SMN2MEN1
SCHEMBL21157146 0.80 GPR3 (0.44) GPR3MAOAMAOBCDC25BEGFR
SCHEMBL21917575 0.72 EGFR (0.38) MAOAMAOBCDC25BEGFRERBB2
SCHEMBL22827953 0.69 MAOA (0.37) MAOAMAOBCDC25BEGFRERBB2
SCHEMBL22827861 0.69 MAOA (0.37) MAOAMAOBCDC25BEGFRERBB2
SCHEMBL21453949 0.68 MAOA (0.45) MAOA
SCHEMBL26222683 0.65 MAOA (0.41) GPR3MAOAMAOBRPS6KA3CYP3A4
SCHEMBL89175 0.64 EGFR (0.36) EGFRERBB2
SCHEMBL89180 0.64 EGFR (0.33) EGFRERBB2SIGMAR1TDP1MAPT
SCHEMBL88782 0.64 CA9 (0.41) EGFRERBB2MEN1KMT2A

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-20190214577-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, POLYMER, MIXTURE, FORMULATION, AND ORGANIC ELECTRONIC DEVICE GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-07-11 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 (1 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-20190214577-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, POLYMER, MIXTURE, FORMULATION, AND ORGANIC ELECTRONIC DEVICE TEAD2, TEAD3, TEAD1 GPR3 3464/4885MAOA 313/4885MAOB 461/4885

“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.