SCHEMBL22356388

SCHEMBL22356388

C=CC(=O)Oc1cccc(N(C)c2nc(N(C)c3cccc(OC(=O)C=C)c3)nc(N(C)c3cccc(OC(=O)C=C)c3)n2)c1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BCHE P06276 4/20 0.41
ACHE P22303 3/20 0.41
MTNR1A P48039 7/20 0.39
MTNR1B P49286 7/20 0.39
BTK Q06187 2/20 0.37
EGFR P00533 2/20 0.37
JAK3 P52333 1/20 0.37
THRB P10828 2/20 0.37
LMNA P02545 2/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B2 P37059 2/20 0.35
HSD17B1 P14061 1/20 0.35

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
SCHEMBL22356324 0.83 THRB (0.56) MTNR1AMTNR1BBTKTHRB
SCHEMBL1055225 0.83 BCHE (0.56) BCHEACHEMTNR1AMTNR1BTHRB
SCHEMBL13777528 0.83 MTNR1A (0.48) BCHEACHEMTNR1AMTNR1BTHRB
SCHEMBL22356393 0.82 BCHE (0.40) BCHEACHEMTNR1AMTNR1BEGFR
SCHEMBL11987123 0.80 KMT2A (0.41) BCHEACHEMTNR1AMTNR1BEGFR
SCHEMBL22356374 0.77 THRB (0.43) BCHEBTKTHRBLMNAKMT2A
SCHEMBL3996164 0.77 KMT2A (0.53) BCHEACHEMTNR1AMTNR1BTHRB
SCHEMBL15067727 0.76 MTNR1A (0.48) BCHEACHEMTNR1AMTNR1BTHRB
SCHEMBL9915698 0.76 BCHE (0.44) BCHEACHEMTNR1AMTNR1BEGFR
SCHEMBL9915803 0.76 BCHE (0.44) BCHEACHEMTNR1AMTNR1BEGFR

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 BCHE 4810/4885ACHE 4570/4885MTNR1A 1254/4885

“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.