SCHEMBL20053525

SCHEMBL20053525

CCc1c(C(C)C)ccc2c3ccccc3n(C(C)C)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
MAPT P10636 3/20 0.40
MAPK1 P28482 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
ATM Q13315 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
UTS2R Q9UKP6 1/20 0.34
POLB P06746 3/20 0.34
HTT P42858 2/20 0.34
NPY5R Q15761 3/20 0.34
PRKD3 O94806 1/20 0.34
PRKCG P05129 1/20 0.34
PRKCB P05771 1/20 0.34
PRKCA P17252 1/20 0.34
PRKCH P24723 1/20 0.34

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
SCHEMBL21726272 0.89 ALDH1A1 (0.33) TSHRMAPTMAPK1CASP1CASP7
SCHEMBL20362766 0.84 ALKBH5 (0.46) TSHRMAPTATMMEN1KMT2A
SCHEMBL16640327 0.80 MAPT (0.43) TSHRMAPTMAPK1CASP1CASP7
SCHEMBL18610705 0.79 MAPT (0.42) TSHRMAPTMAPK1CASP1CASP7
SCHEMBL16640352 0.78 BCHE (0.43) TSHRMAPTMAPK1CASP1CASP7
SCHEMBL20053562 0.77 TSHR (0.38) TSHRMAPTMAPK1CASP1CASP7
SCHEMBL25953765 0.73 BCHE (0.40) TSHRMAPTMAPK1CASP1CASP7
SCHEMBL23229266 0.72 ALDH1A1 (0.34) TSHRMAPTMAPK1CASP1CASP7
SCHEMBL25702394 0.71 ALKBH5 (0.53) TSHRMAPTMAPK1CASP1CASP7
SCHEMBL16696126 0.71 TSHR (0.50) TSHRMAPTMAPK1CASP1CASP7

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-10937976-B2 Tetradentate platinum and palladium complex emitters containing phenyl-pyrazole and its analogues ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2021-03-02 US disclosed
US-9947881-B2 Platinum complexes and devices ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2018-04-17 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-10937976-B2 Tetradentate platinum and palladium complex emitters containing phenyl-pyrazole and its analogues PDCD1, PDCD11, TYMP TSHR 1135/4885MAPT 360/4885MAPK1 2233/4885

“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.