SCHEMBL22862045

SCHEMBL22862045

COc1cc(C(c2ccc(-c3ccccc3)cc2)c2ccc(N3C(=O)C=CC3=O)c(OC)c2)ccc1N1C(=O)C=CC1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 8/20 0.54
TLR9 Q9NR96 2/20 0.54
G6PD P11413 1/20 0.54
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
HSP90AA1 P07900 2/20 0.43
PKM P14618 2/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
CCR6 P51684 1/20 0.43
CACNA1B Q00975 1/20 0.43
APBA1 Q02410 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
FAAH O00519 6/20 0.43
HTT P42858 1/20 0.40
ATM Q13315 1/20 0.40
KDM4E B2RXH2 1/20 0.39
TDP2 O95551 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL22862071 0.95 TLR9 (0.59) MGLLTLR9G6PDALDH1A1MAPT
SCHEMBL22862093 0.81 MGLL (0.57) MGLLTLR9ALDH1A1MAPTHSP90AA1
SCHEMBL22862185 0.81 MGLL (0.57) MGLLTLR9ALDH1A1MAPTHSP90AA1
SCHEMBL22862131 0.78 MGLL (0.58) MGLLTLR9ALDH1A1MAPTHSP90AA1
SCHEMBL31179956 0.78 TLR9 (0.72) MGLLTLR9G6PDALDH1A1MAPT
SCHEMBL22862100 0.78 MGLL (0.52) MGLLTLR9G6PDALDH1A1MAPT
SCHEMBL22862136 0.75 MGLL (0.53) MGLLTLR9ALDH1A1HSP90AA1PKM
SCHEMBL22862127 0.74 MGLL (0.79) MGLLALDH1A1HSP90AA1PKMMAPK1
SCHEMBL21888681 0.73 MGLL (0.38) MGLLTLR9G6PDALDH1A1HSP90AA1
SCHEMBL22050363 0.73 ALDH1A1 (0.55) ALDH1A1MAPTHTTL3MBTL1CRHBP

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-20210003921-A1 COMPOUND, RESIN, COMPOSITION, AND FILM FORMING MATERIAL FOR LITHOGRAPHY USING THE SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-01-07 US disclosed
EP-3760611-A1 COMPOUND, RESIN, COMPOSITION AND FILM-FORMING MATERIAL FOR LITHOGRAPHY USING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-01-06 EP 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-20210003921-A1 COMPOUND, RESIN, COMPOSITION, AND FILM FORMING MATERIAL FOR LITHOGRAPHY USING THE SAME COL1A1, MLLT3, F12 MGLL 1551/4885TLR9 2020/4885G6PD 3597/4885

“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.