SCHEMBL20286054

SCHEMBL20286054

C=C(C)C(=O)OC1CCN(Cc2ccccc2-c2c3ccc(=[N+](CC)CC)cc-3oc3cc(N(CC)CC)ccc23)CC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.48
▸ USP2 O75604 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ PPARG P37231 1/20 0.48
▸ BLM P54132 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.48
▸ NCOR2 Q9Y618 1/20 0.48
▸ TGM2 P21980 1/20 0.47
▸ CHRM1 P11229 3/20 0.46
▸ FPR2 P25090 4/20 0.42
▸ AVPR2 P30518 4/20 0.41
▸ APLNR P35414 1/20 0.38
▸ TLR7 Q9NYK1 1/20 0.38
▸ SLC6A2 P23975 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38
▸ SLC6A3 Q01959 1/20 0.38
▸ NPY4R P50391 3/20 0.37

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
SCHEMBL20286053 0.88 TGM2 (0.60) MEN1USP2POLBPPARGBLM
SCHEMBL20288680 0.87 TGM2 (0.48) MEN1USP2POLBPPARGBLM
SCHEMBL20288681 0.86 MEN1 (0.54) MEN1USP2POLBPPARGBLM
SCHEMBL16075825 0.84 MEN1 (0.54) MEN1USP2POLBPPARGBLM
SCHEMBL18829074 0.81 MEN1 (0.51) MEN1USP2POLBPPARGBLM
SCHEMBL20288684 0.80 TGM2 (0.56) MEN1USP2POLBPPARGBLM
SCHEMBL20288683 0.79 MEN1 (0.54) MEN1USP2POLBPPARGBLM
SCHEMBL15704723 0.78 MEN1 (0.61) MEN1USP2POLBPPARGBLM
SCHEMBL13609836 0.78 USP2 (0.52) MEN1USP2POLBPPARGBLM
SCHEMBL9001017 0.77 MEN1 (0.57) MEN1USP2POLBPPARGBLM

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-20180171043-A1 XANTHENE-BASED POLYMERIC COMPOUNDS, A RESIN COMPOSITION FOR COLOR FILTER COMPRISING SAME AND A COLOR FILTER USING SAME KYUNG-IN SYBTHETIC CO., LTD. (KR) 2018-06-21 — — 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-20180171043-A1 XANTHENE-BASED POLYMERIC COMPOUNDS, A RESIN COMPOSITION FOR COLOR FILTER COMPRISING SAME AND A COLOR FILTER USING SAME DCXR, SUN2, ABCC1 MEN1 3901/4885USP2 2358/4885POLB 3383/4885

“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.

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