SCHEMBL11359389

SCHEMBL11359389

CN(Cc1cccc(-c2ccc(NC(=O)NC3CCN(Cc4ccccc4)CC3)cc2)c1)C(=O)CN

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 11/20 0.60
▸ KMT2A Q03164 2/20 0.59
▸ DRD2 P14416 1/20 0.59
▸ DRD4 P21917 1/20 0.59
▸ DRD3 P35462 1/20 0.59
▸ DCUN1D1 Q96GG9 3/20 0.57
▸ SIGMAR1 Q99720 1/20 0.57
▸ ALDH1A1 P00352 1/20 0.55
▸ POLB P06746 1/20 0.55
▸ F10 P00742 1/20 0.54
▸ HPN P05981 1/20 0.54
▸ PRSS1 P07477 1/20 0.54
▸ PRSS2 P07478 1/20 0.54
▸ PRSS3 P35030 1/20 0.54
▸ HGFAC Q04756 1/20 0.54
▸ ST14 Q9Y5Y6 1/20 0.54
▸ CCR3 P51677 1/20 0.53
▸ UBE2M P61081 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL19496938 0.89 DRD4 (0.66) KMT2ADRD2DRD4DRD3DCUN1D1
SCHEMBL11370228 0.89 AOC3 (0.63) AOC3KMT2A
SCHEMBL11419285 0.88 DRD2 (0.61) AOC3KMT2ADRD2DRD4SIGMAR1
SCHEMBL11366530 0.87 KMT2A (0.52) AOC3KMT2ADRD2DRD4DRD3
Oxalic Acid SCHEMBL10319591 0.86 DRD2 (0.60) AOC3KMT2ADRD2DRD4SIGMAR1
SCHEMBL11423711 0.85 AOC3 (0.60) AOC3
SCHEMBL11422038 0.83 DRD2 (0.70) AOC3DRD2DRD4
SCHEMBL11422780 0.82 AOC3 (0.58) AOC3
SCHEMBL11365217 0.81 AOC3 (0.66) AOC3
SCHEMBL19496744 0.81 AOC3 (0.64) AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2479165-B1 GLYCINE COMPOUND ASTELLAS PHARMA INC (JP) 2017-10-25 — — EP disclosed
US-8802679-B2 Glycine compound ASTELLAS PHARMA INC. (JP) 2014-08-12 — — US disclosed
US-8802679-B2 Glycine compound ASTELLAS PHARMA INC. (JP) 2014-08-12 — — US disclosed
US-20120184520-A1 GLYCINE COMPOUND ASTELLAS PHARMA INC. (JP) 2012-07-19 — — US disclosed
US-20120184520-A1 GLYCINE COMPOUND ASTELLAS PHARMA INC. (JP) 2012-07-19 — — 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-20120184520-A1 GLYCINE COMPOUND SLC5A1, AQP1, VAPB AOC3 894/4885KMT2A 4626/4885DRD2 1754/4885

“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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