SCHEMBL22356478

SCHEMBL22356478

C=CC(=O)Oc1ccc(Nc2nc(Nc3ccccc3)nc(Nc3cccc(Nc4nc(Nc5ccccc5)nc(Nc5ccc(C=C)cc5)n4)c3)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RHOA P61586 1/20 0.48
EGFR P00533 14/20 0.47
BTK Q06187 8/20 0.47
ITK Q08881 3/20 0.43
ALDH1A1 P00352 1/20 0.42
HSP90AA1 P07900 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
DDX3X O00571 1/20 0.41
JAK2 O60674 1/20 0.40
LYN P07948 1/20 0.40
TEC P42680 1/20 0.40
TXK P42681 1/20 0.40
BMX P51813 1/20 0.40
JAK3 P52333 1/20 0.40
CD69 Q07108 1/20 0.40
FLT3 P36888 1/20 0.40
BLK P51451 1/20 0.40

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
SCHEMBL22356433 0.94 RHOA (0.54) RHOAEGFRBTKITKALDH1A1
SCHEMBL22356391 0.94 RHOA (0.54) RHOAEGFRBTKITKALDH1A1
SCHEMBL22356392 0.91 RHOA (0.49) RHOAEGFRBTKITKJAK2
SCHEMBL22356381 0.90 RHOA (0.51) RHOAEGFRBTKITKALDH1A1
SCHEMBL22356446 0.89 MAPT (0.51) RHOAEGFRBTKITKALDH1A1
SCHEMBL22356481 0.89 MAPT (0.51) RHOAEGFRBTKITKALDH1A1
SCHEMBL22356450 0.89 MAPT (0.51) RHOAEGFRBTKITKALDH1A1
SCHEMBL22356482 0.89 MAPT (0.51) RHOAEGFRBTKITKALDH1A1
SCHEMBL22356444 0.85 RHOA (0.55) RHOAEGFRBTKITK
SCHEMBL22356451 0.85 RHOA (0.55) RHOAEGFRBTKITK

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-20200262798-A1 NOVEL TRIAZINE DERIVATIVE AND PHOTOSENSITIVE COMPOSITION COMPRISING SAME TREEEL CO., LTD (KR) 2020-08-20 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-20200262798-A1 NOVEL TRIAZINE DERIVATIVE AND PHOTOSENSITIVE COMPOSITION COMPRISING SAME TYR, CRY2, CRY1 RHOA 3916/4885EGFR 2575/4885BTK 1760/4885

“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.