SCHEMBL2646514

SCHEMBL2646514

NC(=O)c1ccc(Oc2cc3nc(-c4ccccn4)[nH]c3cc2Oc2cccnc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 4/20 0.60
GCK P35557 13/20 0.59
F2 P00734 1/20 0.48
F10 P00742 1/20 0.48
F7 P08709 1/20 0.48
KDM4E B2RXH2 1/20 0.47
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
PKM P14618 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 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
SCHEMBL2646351 0.93 CHEK2 (0.55) CHEK2GCKF2F10F7
SCHEMBL2645280 0.89 GCK (0.52) CHEK2GCKNPC1RAB9A
SCHEMBL2645717 0.88 GCK (0.53) CHEK2GCKNPC1RAB9A
SCHEMBL2645213 0.88 GCK (0.51) CHEK2GCKNPC1RAB9A
SCHEMBL2645464 0.88 NPC1 (0.60) GCKKDM4ENPC1LMNAMAPT
SCHEMBL2646017 0.88 CHEK2 (0.48) CHEK2GCKF2F10F7
SCHEMBL2645528 0.86 GCK (0.60) CHEK2GCKF2F10F7
SCHEMBL2646360 0.85 CHEK2 (0.58) CHEK2GCK
SCHEMBL2645471 0.85 GCK (0.62) CHEK2GCKF2F10F7
SCHEMBL2643775 0.84 GCK (0.56) CHEK2GCKF2F10F7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1702919-B1 NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE MSD KK (JP) 2012-05-30 EP disclosed
US-7728025-B2 2-heteroaryl-substituted benzimidazole derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-06-01 US disclosed
US-20080070928-A1 Novel 2-Heteroaryl-Substituted Benzimidazole Derivative MSD K.K. (JP) 2008-03-20 US disclosed
EP-1702919-A1 NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-09-20 EP 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-20080070928-A1 Novel 2-Heteroaryl-Substituted Benzimidazole Derivative GCK, GCKR, HK1 CHEK2 2611/4885GCK 1/4885F2 4194/4885

“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.