SCHEMBL6140255

SCHEMBL6140255

COc1ccc(CN2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ VEGFA P15692 1/20 0.53
▸ EGLN1 Q9GZT9 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ ALDH1A1 P00352 9/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ HTT P42858 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ TSHR P16473 3/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ CPT1B Q92523 1/20 0.45
▸ CHRM2 P08172 2/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ SLC6A4 P31645 1/20 0.44
▸ OPRD1 P41143 1/20 0.44
▸ OPRK1 P41145 1/20 0.44
▸ APOBEC3A P31941 1/20 0.43
▸ CTDSP1 Q9GZU7 1/20 0.43
▸ APOBEC3G Q9HC16 1/20 0.43

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
SCHEMBL24099834 0.82 VEGFA (0.49) VEGFAEGLN1ALDH1A1KDM4EPKM
SCHEMBL28566297 0.80 VEGFA (0.65) VEGFAEGLN1ALDH1A1KDM4EHTT
SCHEMBL15094126 0.79 KDM4E (0.53) ALDH1A1KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL7758530 0.79 GAA (0.57) CYP2C19ALDH1A1KDM4EHTTMEN1
SCHEMBL8947821 0.79 MEN1 (0.61) CYP2C19ALDH1A1KDM4EHTTPKM
SCHEMBL20137050 0.78 VEGFA (0.54) VEGFAEGLN1ALDH1A1KDM4EMEN1
SCHEMBL1713785 0.77 ALDH1A1 (0.52) VEGFAEGLN1CYP2C19ALDH1A1KDM4E
SCHEMBL28576436 0.77 VEGFA (0.75) VEGFAEGLN1ALDH1A1KDM4EMEN1
SCHEMBL2936174 0.77 ALDH1A1 (0.47) VEGFAEGLN1CYP2C19ALDH1A1KDM4E
SCHEMBL15302911 0.77 VEGFA (0.46) VEGFAEGLN1CYP2C19ALDH1A1KDM4E

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
EP-1277746-B1 N-benzylpiperazine derivatives, process for their preparation and pharmaceutical compositions thereof SERVIER LAB (FR) 2005-05-11 — — EP disclosed
US-6686360-B2 ANTIISCHEMIC AGENTS LES LABORATOIRES SERVIER (FR) 2004-02-03 — — US disclosed
US-20030158207-A1 N-benzylpiperazine compounds LES LABORATOIRES SERVIER (FR) 2003-08-21 — — US disclosed
EP-1277746-A2 N-benzylpiperazine derivatives, process for their preparation and pharmaceutical compositions thereof Les Laboratoires Servier (FR) 2003-01-22 — — EP 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-20030158207-A1 N-benzylpiperazine compounds NPPA, BAD, GLS VEGFA 2640/4885EGLN1 582/4885CYP2C19 1103/4885

“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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