SCHEMBL19734278

SCHEMBL19734278

CCCC(CCC)NC(=O)c1cc(C2CC2)on1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 13/20 0.56
RAB9A P51151 3/20 0.53
NPC1 O15118 2/20 0.53
TSHR P16473 1/20 0.53
PSMB8 P28062 1/20 0.53
PSMB9 P28065 1/20 0.53
PSMB5 P28074 1/20 0.53
STAT1 P42224 1/20 0.50
ALDH1A1 P00352 1/20 0.48
HSD17B10 Q99714 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
SCHEMBL19079433 0.82 SMYD3 (0.58) SMYD3PSMB8PSMB9PSMB5
SCHEMBL19079182 0.79 SMYD3 (0.56) SMYD3RAB9ANPC1TSHRPSMB8
SCHEMBL19079439 0.78 SMYD3 (0.62) SMYD3
SCHEMBL23507683 0.77 SMYD3 (0.47) SMYD3RAB9ANPC1TSHRPSMB8
SCHEMBL19079458 0.77 SMYD3 (0.58) SMYD3
SCHEMBL19079174 0.77 SMYD3 (0.56) SMYD3RAB9ANPC1TSHRPSMB8
SCHEMBL22518513 0.76 RAB9A (0.63) SMYD3RAB9ANPC1TSHRSTAT1
SCHEMBL2618802 0.76 RAB9A (0.64) SMYD3RAB9ANPC1TSHRSTAT1
SCHEMBL19079455 0.75 SMYD3 (0.58) SMYD3
SCHEMBL19079454 0.75 SMYD3 (0.52) SMYD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10577363-B2 Substituted piperidine compounds Epizyme, Inc. (US) 2020-03-03 US disclosed
US-20170362217-A1 Substituted Piperidine Compounds Epizyme, Inc. (US) 2017-12-21 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 (2 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-10577363-B2 Substituted piperidine compounds SMYD3, SMYD2, SNRPD3 SMYD3 1/4885RAB9A 210/4885NPC1 2214/4885
US-20170362217-A1 Substituted Piperidine Compounds SMYD3, SMYD2, SNRPD3 SMYD3 1/4885RAB9A 210/4885NPC1 2214/4885

“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.