SCHEMBL4938118

SCHEMBL4938118

NC1N=CC=CC1(N)Cc1cccc(-c2ccccc2)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ AGXT P21549 2/20 0.42
▸ NAAA Q02083 1/20 0.35
▸ AOC3 Q16853 3/20 0.33
▸ CYP11B1 P15538 2/20 0.33
▸ CYP11B2 P19099 2/20 0.33
▸ MPO P05164 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.33
▸ CYP19A1 P11511 1/20 0.33
▸ MAOA P21397 2/20 0.32
▸ KDM1A O60341 1/20 0.32
▸ PRKCI P41743 1/20 0.32
▸ NR4A2 P43354 1/20 0.32
▸ BACE1 P56817 1/20 0.31
▸ TAAR1 Q96RJ0 1/20 0.31
▸ GPR84 Q9NQS5 1/20 0.31

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
SCHEMBL4938110 0.87 IDO1 (0.38) AGXTMAOAKDM1ATAAR1
SCHEMBL4931182 0.87 BACE1 (0.38) AGXTBACE1
SCHEMBL20553211 0.87 MAOA (0.39) MAOAKDM1A
SCHEMBL4933092 0.86 EPHX2 (0.44) CYP11B1CYP11B2CYP19A1KDM1ABACE1
SCHEMBL4931268 0.84 PRMT6 (0.44) TAAR1
SCHEMBL4937791 0.82 MAOB (0.46) MAOAKDM1ANR4A2
SCHEMBL4941227 0.81 BACE1 (0.44) MPOMAOAKDM1ABACE1
SCHEMBL4939325 0.81 BACE1 (0.45) CYP11B1CYP11B2BACE1
SCHEMBL4931411 0.80 KDM1A (0.44) MPOMAOAKDM1A
SCHEMBL4935935 0.79 HSD17B10 (0.37) —

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-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

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 AGXT 1125/4885NAAA 478/4885AOC3 873/4885

“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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