SCHEMBL6095407

SCHEMBL6095407

FC(F)(F)c1ccc(N2CCN(Cc3nc4ccccc4n3Cc3nc4ccccc4[nH]3)CC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 14/20 0.64
GRM2 Q14416 5/20 0.64
NPC1 O15118 1/20 0.57
GAA P10253 1/20 0.57
HTR1A P08908 1/20 0.52
ADRA2C P18825 1/20 0.52
HTR2A P28223 1/20 0.52
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.52
HTT P42858 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CACNA1G O43497 1/20 0.50
CACNA1B Q00975 1/20 0.50
KCNH2 Q12809 1/20 0.50
DRD2 P14416 2/20 0.47

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
SCHEMBL6095533 0.90 DRD4 (0.56) DRD4GRM2NPC1GAAHTR1A
SCHEMBL6874013 0.87 DRD4 (0.56) DRD4GRM2NPC1GAAHTR1A
SCHEMBL6096279 0.79 DRD4 (0.76) DRD4GRM2MAPTDRD2
SCHEMBL6095609 0.76 HTT (0.49) DRD4NPC1GAAHTTCACNA1G
SCHEMBL6787298 0.76 DRD4 (1.00) DRD4NPC1GAAHTR1AADRA2C
SCHEMBL23964164 0.75 DRD4 (0.68) DRD4GRM2NPC1GAAHTR1A
SCHEMBL4809921 0.75 DRD4 (1.00) DRD4GRM2NPC1GAAHTR1A
SCHEMBL23964171 0.74 DRD4 (0.82) DRD4GRM2NPC1GAAHTR1A
SCHEMBL21083242 0.74 CYP1A2 (0.74) HTR2ALMNAMAPTKCNH2
SCHEMBL29368403 0.74 CYP1A2 (0.74) HTR2ALMNAMAPTKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7030150-B2 Benzimidazole compounds and antiviral uses thereof TRIMERIS, INC. 2006-04-18 US claimed
US-20030119754-A1 Benzimidazole compounds and antiviral uses thereof TRIMERIS, INC. 2003-06-26 US claimed
WO-2002092575-A1 BENZIMIDAZOLE COMPOUNDS AND ANTIVIRAL USES THEREOF TRIMERIS, INC. (US) 2002-11-21 WO claimed
US-20060142365-A1 Benzimidazole compounds and antiviral uses thereof TRIMERIS, INC. 2006-06-29 US disclosed
US-7030150-B2 Benzimidazole compounds and antiviral uses thereof TRIMERIS, INC. 2006-04-18 US disclosed
US-20030119754-A1 Benzimidazole compounds and antiviral uses thereof TRIMERIS, INC. 2003-06-26 US disclosed
WO-2002092575-A1 BENZIMIDAZOLE COMPOUNDS AND ANTIVIRAL USES THEREOF TRIMERIS, INC. (US) 2002-11-21 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 (2 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-20060142365-A1 Benzimidazole compounds and antiviral uses thereof MAVS, ZC3HAV1, TIMM13 DRD4 1827/4885GRM2 4337/4885NPC1 1050/4885
US-20030119754-A1 Benzimidazole compounds and antiviral uses thereof MAVS, ZC3HAV1, TIMM13 DRD4 1827/4885GRM2 4337/4885NPC1 1050/4885

“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.