SCHEMBL6880434

SCHEMBL6880434

OCC1CCCN1Cc1nc2cccnc2n1Cc1nc2ccccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 12/20 0.47
HTT P42858 1/20 0.42
PDE10A Q9Y233 2/20 0.42
DRD2 P14416 1/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
OPRK1 P41145 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
PRKG1 Q13976 1/20 0.40
KCNH2 Q12809 1/20 0.40
GRIN1 Q05586 1/20 0.39
GRIN2B Q13224 1/20 0.39
HPGD P15428 1/20 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
SCHEMBL6881767 0.90 DRD4 (0.45) DRD4HTTDRD2KDM4EALDH1A1
SCHEMBL6095517 0.86 KCNH2 (0.48) DRD4HTTPDE10AKDM4EALDH1A1
SCHEMBL6093816 0.86 KCNH2 (0.48) DRD4HTTPDE10AKDM4EALDH1A1
SCHEMBL6882898 0.83 DRD4 (0.48) DRD4HTTPDE10ADRD2KDM4E
SCHEMBL13559752 0.80 KCNH2 (0.52) KCNH2
SCHEMBL6880423 0.79 DRD4 (0.54) DRD4HTTDRD2KDM4EALDH1A1
SCHEMBL6881772 0.78 DRD4 (0.48) DRD4HTTDRD2KDM4EALDH1A1
SCHEMBL6881688 0.77 LMNA (0.52) DRD4HTTPDE10ADRD2KDM4E
SCHEMBL6097411 0.76 HTT (0.46) DRD4HTTKDM4EALDH1A1CYP3A4
SCHEMBL6880280 0.76 HPGD (0.67) DRD4HTTDRD2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040166137-A1 Hetero-substituted benzimidazole compounds and antiviral uses thereof TRIMERIS, INC. 2004-08-26 US disclosed
WO-2004043913-A2 HETERO-SUBSTITUTED BENZIMIDAZOLE COMPOUNDS AND ANTIVIRAL USES THEREOF TRIMERIS, INC. (US) 2004-05-27 WO 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-20040166137-A1 Hetero-substituted benzimidazole compounds and antiviral uses thereof MAVS, TIMM13, TIMM10 DRD4 1550/4885HTT 1686/4885PDE10A 4816/4885

“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.