SCHEMBL23575873

SCHEMBL23575873

NCCC(=O)NC1CCC(NC(=O)Cc2cc(F)cc(F)c2)CC1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 15/20 0.61
SIGMAR1 Q99720 4/20 0.57
SELL P14151 1/20 0.49
SELP P16109 1/20 0.49
SELE P16581 1/20 0.49

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
SCHEMBL19710224 1.00 SMYD3 (0.61) SMYD3SIGMAR1SELLSELPSELE
SCHEMBL19710155 0.85 SMYD3 (0.61) SMYD3SIGMAR1
SCHEMBL21490175 0.85 SMYD3 (0.61) SMYD3SIGMAR1
SCHEMBL21490141 0.85 SIGMAR1 (0.56) SMYD3SIGMAR1SELLSELPSELE
SCHEMBL19701362 0.85 SIGMAR1 (0.56) SMYD3SIGMAR1SELLSELPSELE
SCHEMBL6874316 0.79
Hydrochloric Acid SCHEMBL5114877 0.77 SMYD3 (0.57) SMYD3
SCHEMBL21489852 0.77 SMYD3 (0.56) SMYD3
SCHEMBL19710379 0.77 SMYD3 (0.56) SMYD3
SCHEMBL30590284 0.76 LMNA (0.52) SMYD3SIGMAR1SELLSELPSELE

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-20210198252-A1 SMYD INHIBITORS EPIZYME INC (US) 2021-07-01 US claimed

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-20210198252-A1 SMYD INHIBITORS SMYD3, SMYD2, SMURF2 SMYD3 1/4885SIGMAR1 1193/4885SELL 4438/4885

“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.