SCHEMBL5114083

SCHEMBL5114083

Cn1c(CCCN)nc2ccccc21

nearest known ligand 0.88

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.88
NPC1 O15118 4/20 0.61
RAB9A P51151 4/20 0.61
SMN1; SMN2 Q16637 4/20 0.61
GAA P10253 1/20 0.61
HDAC6 Q9UBN7 1/20 0.59
PDE10A Q9Y233 2/20 0.57
LMNA P02545 2/20 0.54
KDM4E B2RXH2 1/20 0.53
POLB P06746 1/20 0.53
PKM P14618 1/20 0.51
ALDH1A1 P00352 1/20 0.51
RECQL P46063 1/20 0.51
TSHR P16473 2/20 0.50
CYP2D6 P10635 1/20 0.50

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
SCHEMBL8088128 0.95 MAPT (0.97) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL230079 0.94 MAPT (1.00) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL855166 0.90 MAPT (0.77) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL14050118 0.90 MAPT (0.76) MAPTNPC1RAB9ASMN1; SMN2GAA
Hydrochloric Acid SCHEMBL14736626 0.88 MAPT (0.74) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL13263650 0.85 MAPT (0.69) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL4485011 0.83 MAPT (0.68) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL17933567 0.83 MAPT (0.72) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL2929122 0.82 MAPT (0.66) MAPTNPC1RAB9ASMN1; SMN2GAA
SCHEMBL17933568 0.82 MAPT (0.70) MAPTNPC1RAB9ASMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1983992-A2 2-IMINO-BENZIMIDAZOLES Abbott Laboratories (US) 2008-10-29 EP disclosed
US-20070232673-A1 2-Imino-benzimidazoles ABBOTT LABORATORIES 2007-10-04 US disclosed
WO-2007084728-A2 2-IMINO-BENZIMIDAZOLES ABBOTT LABORATORIES (US) 2007-07-26 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-20070232673-A1 2-Imino-benzimidazoles CYP2C19, UGT2B7, UGT2B17 MAPT 2918/4885NPC1 234/4885RAB9A 1111/4885

“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.