SCHEMBL3568288

SCHEMBL3568288

O=C(O)c1ccc2[nH]c(-c3ccc(Cc4cc5c(cc4Cl)OCO5)cc3)nc2c1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CHEK2 O96017 13/20 0.72
▸ KDM4E B2RXH2 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ SIRT2 Q8IXJ6 1/20 0.43
▸ SIRT1 Q96EB6 1/20 0.43
▸ SIRT3 Q9NTG7 1/20 0.43
▸ NR4A2 P43354 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ HPGD P15428 2/20 0.43
▸ ACVR1B P36896 1/20 0.42
▸ TGFBR1 P36897 1/20 0.42

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
SCHEMBL3574620 0.91 CHEK2 (0.86) CHEK2
SCHEMBL3568831 0.86 CHEK2 (0.71) CHEK2KDM4EKMT2AMEN1MAPT
SCHEMBL5178365 0.83 CHEK2 (0.67) CHEK2KDM4EKMT2AMEN1MAPT
SCHEMBL3571326 0.81 CHEK2 (0.67) CHEK2KDM4EKMT2AMEN1SIRT2
SCHEMBL3570736 0.81 CHEK2 (0.70) CHEK2KDM4EKMT2AMEN1MAPT
SCHEMBL3573484 0.81 CHEK2 (0.73) CHEK2KDM4EKMT2AMEN1MAPT
SCHEMBL5177560 0.78 CHEK2 (0.51) CHEK2KDM4EKMT2ARAB9ANR4A2
SCHEMBL3572089 0.77 CHEK2 (0.69) CHEK2KDM4EKMT2AMEN1POLB
SCHEMBL3562320 0.77 CHEK2 (0.85) CHEK2
SCHEMBL28930292 0.77 KDM4E (0.68) CHEK2KDM4EKMT2ARAB9ANR4A2

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
US-7687639-B2 Substituted benzimidazoles and imidazo-[4,5]-pyridines JANSSEN PHARMACEUTICA N.V. (BE) 2010-03-30 — — US disclosed
US-20060252793-A1 Substituted benzimidazoles and imidazo-[4,5]-pyridines BW CONVERTING AB (SE) 2006-11-09 — — US disclosed
US-7132440-B2 Substituted benzimidazoles and imidazo-[4,5]-pyridines JANSSEN PHARMACEUTICA, N.V. (BE) 2006-11-07 — — 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-20060252793-A1 Substituted benzimidazoles and imidazo-[4,5]-pyridines CDKN1A, DDB1, TMBIM6 CHEK2 14/4885KDM4E 3815/4885KMT2A 4404/4885

“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.

Send feedback