SCHEMBL6882898

SCHEMBL6882898

OCC1CCCN(Cc2nc3cccnc3n2Cc2nc3ccccc3[nH]2)C1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 11/20 0.48
SLC40A1 Q9NP59 1/20 0.47
HTT P42858 1/20 0.46
DRD2 P14416 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2B Q13224 1/20 0.42
PDE10A Q9Y233 2/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX15 P16050 1/20 0.42
OPRK1 P41145 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
CYP2D6 P10635 2/20 0.41
DRD3 P35462 3/20 0.40
ENPP2 Q13822 1/20 0.40

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
SCHEMBL6092572 0.87 HTT (0.49) DRD4HTTGRIN1GRIN2BKDM4E
SCHEMBL6880434 0.83 DRD4 (0.47) DRD4HTTDRD2GRIN1GRIN2B
SCHEMBL6880423 0.81 DRD4 (0.54) DRD4HTTDRD2GRIN1GRIN2B
SCHEMBL6880280 0.79 HPGD (0.67) DRD4HTTDRD2KDM4EALDH1A1
SCHEMBL6881533 0.78 DRD4 (0.49) DRD4HTTDRD2PDE10AKDM4E
SCHEMBL6881767 0.78 DRD4 (0.45) DRD4HTTDRD2GRIN1GRIN2B
SCHEMBL6881731 0.77 DRD4 (0.52) DRD4HTTDRD2KDM4EALDH1A1
SCHEMBL6878954 0.77 DRD4 (0.52) DRD4HTTDRD2GRIN1GRIN2B
SCHEMBL6881772 0.77 DRD4 (0.48) DRD4HTTDRD2KDM4EALDH1A1
SCHEMBL6883746 0.77 DRD4 (0.51) 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 1 patent. 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

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 1550/4885SLC40A1 3431/4885HTT 1686/4885

“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.