SCHEMBL19691092

SCHEMBL19691092

O=C(NC1CC1)c1ncon1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SMYD3 Q9H7B4 9/20 0.43
▸ TSHR P16473 3/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ MLLT1 Q03111 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ HDAC4 P56524 1/20 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
SCHEMBL8458175 0.73 — —
SCHEMBL18611840 0.69 ACKR3 (0.49) SMYD3TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL2542380 0.69 SMYD3 (0.48) SMYD3NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL21621346 0.69 CES1 (0.38) RAB9AL3MBTL1HDAC4
SCHEMBL4474109 0.68 SMYD3 (0.43) SMYD3TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL14108403 0.68 MLLT1 (0.47) SMYD3TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL27854607 0.67 ALDH1A1 (0.58) TSHRNPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL21489688 0.67 SMYD3 (0.55) SMYD3
SCHEMBL19701331 0.67 SMYD3 (0.55) SMYD3
Hydrochloric Acid SCHEMBL28847292 0.67 MLLT1 (0.46) SMYD3TSHRNPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230101819-A1 SMYD Inhibitors EPIZYME INC (US) 2023-03-30 — — US disclosed
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 (5 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 1/4885TSHR 3994/4885NPC1 3576/4885
US-20170355695-A1 SMYD Inhibitors SMYD3, SMYD2, SMURF2 SMYD3 1/4885TSHR 4530/4885NPC1 3715/4885
US-20210198252-A1 SMYD INHIBITORS SMYD3, SMYD2, SMURF2 SMYD3 1/4885TSHR 4520/4885NPC1 3734/4885
US-20190322660-A1 SMYD INHIBITORS SMYD2, SMYD3, SMURF2 SMYD3 2/4885TSHR 4703/4885NPC1 3830/4885
US-20230101819-A1 SMYD Inhibitors SMYD3, SMYD2, SMURF2 SMYD3 1/4885TSHR 4510/4885NPC1 3716/4885

“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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