SCHEMBL4938110

SCHEMBL4938110

NC1N=CC=CC1(N)Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.38
▸ AGXT P21549 2/20 0.38
▸ TAAR1 Q96RJ0 2/20 0.37
▸ MAOB P27338 5/20 0.32
▸ MAOA P21397 4/20 0.32
▸ SRR Q9GZT4 2/20 0.31
▸ PSAT1 Q9Y617 2/20 0.31
▸ ABCC4 O15439 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ PTGS1 P23219 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ HSD11B1 P28845 1/20 0.30
▸ KDM1A O60341 4/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ KCNH2 Q12809 1/20 0.30

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
SCHEMBL20553211 0.91 MAOA (0.39) IDO1MAOBMAOAHSD11B1KDM1A
SCHEMBL4938118 0.87 AGXT (0.42) AGXTTAAR1MAOAKDM1A
SCHEMBL4931411 0.80 KDM1A (0.44) MAOBMAOAKDM1ARAB9A
SCHEMBL4938194 0.78 ALDH1A1 (0.44) LMNATSHRHTTMEN1RAB9A
SCHEMBL4939777 0.76 KDM1A (0.40) IDO1TAAR1MAOBMAOALMNA
SCHEMBL4937791 0.75 MAOB (0.46) MAOBMAOAKDM1AKMT2A
SCHEMBL4933092 0.74 EPHX2 (0.44) KDM1AMEN1
SCHEMBL4934778 0.72 CYP11B1 (0.46) LMNA
SCHEMBL4938385 0.71 KDM4E (0.50) LMNATSHRHTTMEN1KMT2A
SCHEMBL394270 0.65 MAOA (0.41) IDO1AGXTMAOBMAOATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287399-A1 Substituted Aminopyridines and Uses Thereof ASTRAZENECA AB (SE) 2008-11-20 — — US claimed
US-20080287399-A1 Substituted Aminopyridines and Uses Thereof ASTRAZENECA AB (SE) 2008-11-20 — — US disclosed
EP-1831170-A1 SUBSTITUTED AMINOPYRIDINES AND USES THEREOF AstraZeneca AB (SE) 2007-09-12 — — EP disclosed
WO-2006065204-A1 SUBSTITUTED AMINOPYRIDINES AND USES THEREOF ASTRAZENECA AB (SE) 2006-06-22 — — WO 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-20080287399-A1 Substituted Aminopyridines and Uses Thereof PSEN2, SLC1A2, PSEN1 IDO1 2550/4885AGXT 1125/4885TAAR1 450/4885

“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.

Send feedback