SCHEMBL6792689

SCHEMBL6792689

CC(CN(C=O)c1ccccc1)c1cc(N)ccn1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 4/20 0.36
ASIC3 Q9UHC3 1/20 0.35
TAAR1 Q96RJ0 1/20 0.32
TSHR P16473 1/20 0.31
ALDH1A1 P00352 1/20 0.30
EGFR P00533 1/20 0.30
KCNH2 Q12809 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
NLRP3 Q96P20 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
NR3C2 P08235 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
Hydrochloric Acid SCHEMBL6793030 0.84 ASIC3 (0.34) OPRD1ASIC3
SCHEMBL6792836 0.81 ALDH1A1 (0.38) ALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL6503516 0.75 ASIC3 (0.37) OPRD1ASIC3TSHRALDH1A1EGFR
SCHEMBL8128151 0.72 ALDH1A1 (0.39) TAAR1TSHRALDH1A1KCNH2
SCHEMBL6164927 0.69 GABRP (0.39) OPRD1ASIC3NR3C2
SCHEMBL6164930 0.69 GABRP (0.39) OPRD1ASIC3NR3C2
Aniline SCHEMBL11231186 0.67 ALDH1A1 (0.48) TAAR1TSHRALDH1A1L3MBTL1
SCHEMBL22780620 0.67 ASIC3 (0.46) ASIC3TAAR1ALDH1A1NR3C2
SCHEMBL293009 0.65 ASIC3 (0.41) ASIC3TSHRALDH1A1NPC1RAB9A
SCHEMBL27582427 0.64 ALDH1A1 (0.42) OPRD1TSHRALDH1A1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040058903-A1 Benzamide compounds as apo b secretion inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-25 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-20040058903-A1 Benzamide compounds as apo b secretion inhibitors APOB, APOL1, SCARB1 OPRD1 288/4885ASIC3 3567/4885TAAR1 1091/4885

“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.