SCHEMBL6482841

SCHEMBL6482841

CCOC(=O)Cn1c(-c2ccccc2)nc2cc(OCCCCCC(=O)OC)ccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 3/20 0.48
HPGD P15428 2/20 0.48
HTT P42858 2/20 0.48
AR P10275 3/20 0.47
HSD17B10 Q99714 2/20 0.46
LTB4R Q15722 1/20 0.46
PDE3B Q13370 3/20 0.46
PDE3A Q14432 3/20 0.46
P2RY12 Q9H244 3/20 0.46
MAPT P10636 3/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
ALOX15 P16050 1/20 0.45
CACNA1B Q00975 1/20 0.45

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
SCHEMBL6483459 0.93 GAA (0.51) GAAL3MBTL1CYP1A2CYP2C9CYP2C19
SCHEMBL6474287 0.90 LTB4R (0.46) GAAL3MBTL1KDM4EHSD17B10LTB4R
SCHEMBL6482127 0.89 PTGER4 (0.49) GAAL3MBTL1ALDH1A1KDM4EHPGD
SCHEMBL6482133 0.85 KDM4E (0.51) L3MBTL1ALDH1A1KDM4EHPGDHTT
SCHEMBL6475234 0.85 DRD3 (0.46) LTB4RPDE3BPDE3AP2RY12PDE2A
SCHEMBL6475231 0.85 DRD3 (0.46) LTB4RPDE3BPDE3AP2RY12PDE2A
SCHEMBL6484042 0.83 TSPO (0.47) GAAL3MBTL1LTB4RPDE3BPDE3A
SCHEMBL6475559 0.83 PDE3B (0.47) GAAL3MBTL1LTB4RPDE3BPDE3A
SCHEMBL6475246 0.82 KDM4E (0.57) KDM4EHSD17B10LTB4RPDE3BPDE3A
SCHEMBL6475479 0.82 PTGER4 (0.47) LTB4RPDE3BPDE3APLA2G2A

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
US-6855714-B2 1-alkyl-2-aryl-benzimidazole derivatives, their use for the production of pharmaceutical agents as well as pharmaceutical preparations that contain these derivatives SCHERING AKTIENGESELLSCHAFT (DE) 2005-02-15 US claimed
EP-1404321-A1 1-ALKYL-2-ARYL-BENZIMIDAZOLE DERIVATIVES, THEIR USE FOR PRODUCING MEDICAMENTS AND PHARMACEUTICAL PREPARATIONS CONTAINING SAID DERIVATIVES Schering Aktiengesellschaft (DE) 2004-04-07 EP claimed
US-20030055057-A1 1-alkyl-2-aryl-benzimidazole derivatives, their use for the production of pharmaceutial agents as well as pharmaceutical preparations that contain these derivatives SCHERING AG (DE) 2003-03-20 US claimed
WO-2003004023-A1 1-ALKYL-2-ARYL-BENZIMIDAZOLE DERIVATIVES, THEIR USE FOR PRODUCING MEDICAMENTS AND PHARMACEUTICAL PREPARATIONS CONTAINING SAID DERIVATIVES SCHERING AKTIENGESELLSCHAFT (DE) 2003-01-16 WO claimed

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-20030055057-A1 1-alkyl-2-aryl-benzimidazole derivatives, their use for the production of pharmaceutial agents as well as pharmaceutical preparations that contain these derivatives ARG2, MSR1, ARG1 GAA 742/4885L3MBTL1 3749/4885CYP1A2 113/4885

“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.