SCHEMBL3458121

SCHEMBL3458121

CC(=O)c1cc2cccnc2nc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.53
KDM4E B2RXH2 3/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
KMT2A Q03164 1/20 0.44
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
MCL1 Q07820 1/20 0.41
ALDH1A1 P00352 4/20 0.39
P2RX7 Q99572 1/20 0.39
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
CA9 Q16790 2/20 0.38
CA12 O43570 1/20 0.38
CYP1A2 P05177 1/20 0.38
NT5E P21589 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL125290 0.87 LMNA (0.51) SMN1; SMN2KDM4EMEN1LMNAKMT2A
SCHEMBL5897292 0.85 LMNA (0.42) SMN1; SMN2KDM4EMEN1LMNAKMT2A
SCHEMBL5200908 0.85 PARP1 (0.50) SMN1; SMN2KDM4EMEN1LMNAKMT2A
SCHEMBL28558680 0.83 ALOX15 (0.49) SMN1; SMN2KDM4ENPC1RAB9AALDH1A1
SCHEMBL28912380 0.80 TSHR (0.52) KDM4EMEN1KMT2ARAB9AMAPT
SCHEMBL9958654 0.78 DHODH (0.49) SMN1; SMN2KDM4EMEN1LMNAKMT2A
SCHEMBL13312285 0.78 MGLL (0.44) KDM4EMEN1LMNAKMT2AALDH1A1
SCHEMBL10233174 0.77 ALDH1A1 (0.49) KDM4EMEN1LMNAKMT2AMAPT
SCHEMBL3893117 0.75 ALDH1A1 (0.53) KDM4EMEN1LMNAKMT2ANPC1
SCHEMBL10278163 0.75 EGLN1 (0.57) SMN1; SMN2KDM4EMEN1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112778306-B Synthesis method of 1, 8-naphthyridine derivative 吉林化工学院 2024-01-26 CN disclosed
CN-112778306-A Synthetic method of 1, 8-naphthyridine derivative 吉林化工学院 2021-05-11 CN disclosed
EP-2258703-A1 Tri- and bi-cyclic heteroaryl histamine-3 receptor ligands Abbott Laboratories (US) 2010-12-08 EP disclosed
US-7205316-B2 Tri- and bi-cyclic heteroaryl histamine-3 receptor ligands ABBOTT LABORATORIES (US) 2007-04-17 US disclosed
EP-1751130-A2 TRI- AND BI-CYCLIC HETEROARYL HISTAMINE-3 RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2007-02-14 EP disclosed
US-20050272736-A1 Tri- and bi-cyclic heteroaryl histamine-3 receptor ligands ABBVIE INC. 2005-12-08 US disclosed
WO-2005113536-A2 TRI- AND BI-CYCLIC HETEROARYL HISTAMINE-3 RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2005-12-01 WO disclosed
US-20050256309-A1 Tri-and bi-cyclic heteroaryl histamine-3 receptor ligands ABBOTT LABORATORIES 2005-11-17 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-20050272736-A1 Tri- and bi-cyclic heteroaryl histamine-3 receptor ligands HRH3, HRH4, HRH2 SMN1; SMN2 4849/4885KDM4E 2908/4885MEN1 1776/4885
US-20050256309-A1 Tri-and bi-cyclic heteroaryl histamine-3 receptor ligands HRH3, HRH4, HRH2 SMN1; SMN2 4849/4885KDM4E 2908/4885MEN1 1776/4885

“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.