SCHEMBL23573367

SCHEMBL23573367

O=C(O)NC1CCN(C(=O)Nc2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 14/20 0.64
▸ TRPV1 Q8NER1 3/20 0.62
▸ KMT2A Q03164 2/20 0.60
▸ LMNA P02545 1/20 0.58
▸ NPSR1 Q6W5P4 1/20 0.58

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
SCHEMBL4011037 0.90 EPHX2 (0.79) EPHX2
SCHEMBL25153767 0.85 EPHX2 (0.68) EPHX2TRPV1KMT2ALMNANPSR1
SCHEMBL23462312 0.85 KMT2A (0.76) EPHX2KMT2ALMNANPSR1
SCHEMBL23573338 0.84 EPHX2 (0.72) EPHX2
SCHEMBL25153759 0.83 MAPT (0.64) EPHX2TRPV1KMT2ALMNANPSR1
SCHEMBL14413758 0.82 TRPV1 (0.62) EPHX2TRPV1
SCHEMBL32660750 0.82 TRPV1 (0.62) EPHX2TRPV1KMT2ALMNANPSR1
SCHEMBL14393776 0.82 EPHX2 (0.70) EPHX2TRPV1KMT2ALMNANPSR1
SCHEMBL25401094 0.82 LMNA (0.59) EPHX2KMT2ALMNANPSR1
SCHEMBL3346367 0.82 EPHX2 (0.79) EPHX2

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-20210198239-A1 COMPOUNDS AND METHODS FOR CD73 MODULATION AND INDICATIONS THEREFOR PLEXXIKON INC. 2021-07-01 — — 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-20210198239-A1 COMPOUNDS AND METHODS FOR CD73 MODULATION AND INDICATIONS THEREFOR ENTPD5, ADORA2A, ENTPD1 EPHX2 959/4885TRPV1 352/4885KMT2A 3173/4885

“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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