SCHEMBL6719649

SCHEMBL6719649

CCCCC(OC(N)=O)(C(=O)NC1CCCCC1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.43
▸ MAPT P10636 1/20 0.43
▸ CCR1 P32246 2/20 0.41
▸ EPHX2 P34913 2/20 0.40
▸ CNR1 P21554 1/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ ICMT O60725 1/20 0.40
▸ ALB P02768 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ CHRM2 P08172 3/20 0.39
▸ CHRM1 P11229 3/20 0.39
▸ CHRM3 P20309 3/20 0.39

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
SCHEMBL5617129 0.78 KIF11 (0.44) MAPTTSHRRAB9ACHRM2CHRM1
SCHEMBL6368657 0.74 ALDH1A1 (0.42) ALDH1A1MAPTCCR1EPHX2HPGD
SCHEMBL6928586 0.70 HDAC3 (0.54) ALDH1A1CCR1EPHX2HPGDRAB9A
SCHEMBL13348713 0.70 EPHX1 (0.51) ALDH1A1CCR1EPHX2HPGDRAB9A
SCHEMBL9667392 0.68 KIF11 (0.44) ALDH1A1MAPTTSHRRAB9ACHRM2
SCHEMBL25464159 0.67 HDAC1 (0.49) ALDH1A1MAPTCCR1RAB9ACHRM2
SCHEMBL11582899 0.67 CCR1 (0.53) ALDH1A1CCR1EPHX2CNR1CNR2
SCHEMBL28033810 0.66 MAPT (0.47) MAPTCHRM2CHRM1CHRM3
SCHEMBL25464076 0.65 MAPT (0.46) ALDH1A1MAPTCCR1EPHX2HPGD
SCHEMBL6946455 0.65 SSTR1 (0.47) CCR1HPGDRAB9ACHRM2CHRM1

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-20040152741-A1 Arylglycine derivatives and their use as glycine transport inhibitors NPS ALLELIX CORPORATION (CA) 2004-08-05 — — 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-20040152741-A1 Arylglycine derivatives and their use as glycine transport inhibitors SLC1A2, SLC1A1, SLC7A11 ALDH1A1 575/4885MAPT 694/4885CCR1 1566/4885

“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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