SCHEMBL19709999

SCHEMBL19709999

CCC(=O)Nc1cccc(C(=O)N[C@H]2CC[C@H](N)CC2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 9/20 1.00
L3MBTL1 Q9Y468 1/20 0.56
ALDH1A1 P00352 2/20 0.52
MAPK1 P28482 1/20 0.52
CCR2 P41597 1/20 0.52
KMT2A Q03164 2/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
ANO1 Q5XXA6 3/20 0.50
MAPK10 P53779 1/20 0.48
MEN1 O00255 1/20 0.48
ADRB2 P07550 1/20 0.48

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
SCHEMBL21490104 1.00 SMYD3 (1.00) SMYD3L3MBTL1ALDH1A1MAPK1CCR2
SCHEMBL19710434 0.86 SMYD3 (1.00) SMYD3ALDH1A1KMT2ANPC1RAB9A
SCHEMBL21489986 0.86 SMYD3 (1.00) SMYD3ALDH1A1KMT2ANPC1RAB9A
SCHEMBL19701231 0.80 SMYD3 (1.00) SMYD3L3MBTL1NPC1RAB9A
SCHEMBL21489853 0.80 SMYD3 (1.00) SMYD3L3MBTL1NPC1RAB9A
SCHEMBL21489836 0.80 SMYD3 (1.00) SMYD3NPC1RAB9A
SCHEMBL19701229 0.80 SMYD3 (1.00) SMYD3NPC1RAB9A
SCHEMBL14198233 0.78 SMYD3 (0.74) SMYD3L3MBTL1ALDH1A1MAPK1KMT2A
SCHEMBL12852600 0.76 SMYD3 (0.64) SMYD3L3MBTL1KMT2ANPC1RAB9A
SCHEMBL21489753 0.76 SMYD3 (1.00) SMYD3CCR2NPC1RAB9A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210198252-A1 SMYD INHIBITORS EPIZYME INC (US) 2021-07-01 US claimed
US-20190322660-A1 SMYD INHIBITORS Epizyme, Inc. 2019-10-24 US claimed
US-20210198252-A1 SMYD INHIBITORS EPIZYME INC (US) 2021-07-01 US disclosed
US-20190322660-A1 SMYD INHIBITORS Epizyme, Inc. 2019-10-24 US disclosed
US-10266526-B2 Substituted 1,2,3-triazoles as SMYD inhibitors for treating cancer Epizyme, Inc. (US) 2019-04-23 US disclosed
US-20170355695-A1 SMYD Inhibitors Epizyme, Inc. (US) 2017-12-14 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 (4 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-10266526-B2 Substituted 1,2,3-triazoles as SMYD inhibitors for treating cancer SMYD3, SMYD2, SNRPD3 SMYD3 1/4885L3MBTL1 632/4885ALDH1A1 1204/4885
US-20170355695-A1 SMYD Inhibitors SMYD3, SMYD2, SMURF2 SMYD3 1/4885L3MBTL1 660/4885ALDH1A1 1533/4885
US-20210198252-A1 SMYD INHIBITORS SMYD3, SMYD2, SMURF2 SMYD3 1/4885L3MBTL1 659/4885ALDH1A1 1575/4885
US-20190322660-A1 SMYD INHIBITORS SMYD2, SMYD3, SMURF2 SMYD3 2/4885L3MBTL1 443/4885ALDH1A1 1125/4885

“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.