SCHEMBL17470979

SCHEMBL17470979

CCC(=O)NCCc1ncc[nH]1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.52
TERT O14746 1/20 0.50
TBXAS1 P24557 2/20 0.46
NAMPT P43490 3/20 0.43
HTR1A P08908 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
FPR2 P25090 1/20 0.40
ACACB O00763 1/20 0.40

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
SCHEMBL7297042 0.91 TBXAS1 (0.51) SMN1; SMN2TERTTBXAS1NAMPTMEN1
SCHEMBL8278814 0.88 TBXAS1 (0.48) TERTTBXAS1NAMPTMTNR1AMTNR1B
Treamid SCHEMBL17483104 0.84 TBXAS1 (0.54) TERTTBXAS1NAMPTMEN1KMT2A
SCHEMBL29145873 0.83 FPR2 (0.51) SMN1; SMN2TERTTBXAS1HTR1ATAAR1
SCHEMBL9081976 0.83 TERT (0.53) SMN1; SMN2TERTTBXAS1NAMPTMEN1
SCHEMBL7426540 0.81 TERT (0.54) SMN1; SMN2TERTTBXAS1NAMPTTAAR1
SCHEMBL9999615 0.81 CYP3A4 (0.54) TERTTBXAS1NAMPT
SCHEMBL28308832 0.80 TERT (0.46) TERTTBXAS1NAMPTFPR2
SCHEMBL13034815 0.79 TERT (0.49) TERTTBXAS1NAMPTKMT2AFPR2
SCHEMBL434372 0.79 TERT (0.49) TERTTBXAS1NAMPTHTR1ATAAR1

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-9776996-B2 Substituted 6,5-fused bicyclic heteroaryl compounds Epizyme, Inc. (US) 2017-10-03 US disclosed
US-20160024081-A1 Substituted 6,5-Fused Bicyclic Heteroaryl Compounds Epizyme, Inc. 2016-01-28 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-20160024081-A1 Substituted 6,5-Fused Bicyclic Heteroaryl Compounds CYP3A5, PAICS, CYP4B1 SMN1; SMN2 4624/4885TERT 488/4885TBXAS1 788/4885

“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.