SCHEMBL6480122

SCHEMBL6480122

Cn1c(=O)c2cccnc2n(Cc2nc3ccccc3n2CCCCF)c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CYP3A4 P08684 1/20 0.41
KDR P35968 1/20 0.40
PTK2 Q05397 1/20 0.40
CNR1 P21554 1/20 0.39
PTK2B Q14289 1/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 2/20 0.39
RECQL P46063 1/20 0.39
TP53 P04637 2/20 0.39
PDE10A Q9Y233 2/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL6783757 0.86 CYP3A4 (0.54) TSHRKDM4ECYP3A4CNR1PTK2B
SCHEMBL7746499 0.74 MEN1 (0.42) TSHRMEN1USP2KMT2AL3MBTL1
SCHEMBL7745852 0.74 CYP3A4 (0.59) TSHRKDM4ECYP3A4PTK2BMEN1
SCHEMBL7746317 0.73 MEN1 (0.43) TSHRLMNAMAPK1HTTMEN1
SCHEMBL7746911 0.72 MEN1 (0.45) TSHRKDM4ELMNAMAPK1HSD17B10
SCHEMBL7741901 0.72 POLB (0.44) TSHRLMNAHTTCYP3A4MEN1
SCHEMBL7746351 0.72 FEN1 (0.44) KDM4ELMNAHTTHSD17B10CYP3A4
SCHEMBL7745921 0.71 MEN1 (0.41) TSHRLMNAMAPK1HTTCYP3A4
SCHEMBL7745691 0.70 SMN1; SMN2 (0.47) TSHRKDM4ELMNAMAPK1CNR1
SCHEMBL7741914 0.70 ALDH1A1 (0.54) KDM4ELMNAMAPK1HTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6844342-B2 Heterocyclic substituted 2-methyl-benzimidazole antiviral agents BRISTOL-MYERS SQUIBB COMPANY (US) 2005-01-18 US disclosed
US-6774134-B2 FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION BRISTOL-MYERS SQUIBB COMPANY 2004-08-10 US disclosed
US-6774134-B2 FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION BRISTOL-MYERS SQUIBB COMPANY 2004-08-10 US disclosed
US-6774134-B2 FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION BRISTOL-MYERS SQUIBB COMPANY 2004-08-10 US disclosed
US-20040067997-A1 Heterocyclic substituted 2-methyl-benzimidazole antiviral agents YU KUO-LONG (US) 2004-04-08 US disclosed
US-20020099208-A1 Heterocyclic substituted 2-methyl-benzimidazole antiviral agents BRISTOL-MYERS SQUIBB COMPANY 2002-07-25 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 (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-20020099208-A1 Heterocyclic substituted 2-methyl-benzimidazole antiviral agents MAVS, ZC3HAV1, EIF2AK2 TSHR 4049/4885KDM4E 294/4885LMNA 2414/4885
US-20040067997-A1 Heterocyclic substituted 2-methyl-benzimidazole antiviral agents MAVS, ZC3HAV1, EIF2AK2 TSHR 4049/4885KDM4E 294/4885LMNA 2414/4885

“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.