SCHEMBL6795421

SCHEMBL6795421

Oc1cccc2nc(Cc3nc4ccccc4[nH]3)[nH]c12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.57
LMNA P02545 2/20 0.57
PKM P14618 2/20 0.57
MAPT P10636 1/20 0.57
HTT P42858 1/20 0.57
HKDC1 Q2TB90 1/20 0.57
DDAH1 O94760 1/20 0.51
POLB P06746 1/20 0.51
F2 P00734 1/20 0.51
F10 P00742 1/20 0.51
F7 P08709 1/20 0.51
TSHR P16473 1/20 0.50
KRAS P01116 1/20 0.48
GRIN1 Q05586 1/20 0.48
GRIN2B Q13224 1/20 0.48
CHRM1 P11229 1/20 0.48
BCHE P06276 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
EGFR P00533 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
Hydrochloric Acid SCHEMBL6791080 0.98 GAA (0.56) GAALMNAPKMMAPTHTT
SCHEMBL6795429 0.84 GRIN1 (0.59) GAALMNAPKMMAPTHTT
Hydrochloric Acid SCHEMBL6791084 0.83 GRIN1 (0.58) GAALMNAPKMMAPTHTT
SCHEMBL230024 0.83 GAA (0.78) GAALMNAPKMMAPTHTT
SCHEMBL9540475 0.83 GAA (0.58) GAAPKMMAPTTSHRGRIN1
SCHEMBL6887750 0.81 GAA (0.73) GAALMNAPKMMAPTHTT
SCHEMBL9533110 0.78 TDP1 (0.41) GAALMNAPKMMAPTHTT
Iodomethane SCHEMBL27491515 0.78 GAA (0.70) GAALMNAPKMDDAH1POLB
SCHEMBL4066028 0.77 KDM4E (0.40) GAALMNAPKMMAPTHTT
SCHEMBL28125053 0.77 ACHE (0.39) GAALMNAPKMMAPTHTT

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
WO-2004066999-A1 COMPOSITIONS CONTAINING 2, 2’ -METHYLENEBISBENZIMIDAZOLE DERIVATIVES FOR TREATING ISCHEMIA-RELATED NEURONAL DAMAGE ELAN PHARMACEUTICALS, INC. (US) 2004-08-12 WO disclosed
US-20040072862-A1 Compositions for treating ischemia-related neuronal damage ELAN PHARMACEUTICALS, INC. 2004-04-15 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-20040072862-A1 Compositions for treating ischemia-related neuronal damage CASP3, NLN, AIFM1 GAA 779/4885LMNA 488/4885PKM 2024/4885

“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.