SCHEMBL5089602

SCHEMBL5089602

O=C1NC(c2ccccc2)=N/C1=C\c1c[nH]c2ncccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.55
KMT2A Q03164 2/20 0.50
NPC1 O15118 2/20 0.48
POLB P06746 2/20 0.48
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 1/20 0.48
TP53 P04637 1/20 0.48
HPGD P15428 1/20 0.48
HASPIN Q8TF76 4/20 0.47
CCNT1 O60563 2/20 0.47
CDK9 P50750 2/20 0.47
CDC7 O00311 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
MAPT P10636 2/20 0.43
BLM P54132 1/20 0.43
CHEK2 O96017 1/20 0.42
CDK1 P06493 1/20 0.42
SRC P12931 1/20 0.42
CSNK2A2 P19784 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
SCHEMBL5094570 1.00 CHEK1 (0.55) CHEK1KMT2ANPC1POLBRAB9A
SCHEMBL4764261 1.00 CHEK1 (0.55) CHEK1KMT2ANPC1POLBRAB9A
SCHEMBL5094739 0.92 CHEK1 (0.51) CHEK1KMT2ANPC1POLBRAB9A
SCHEMBL5094745 0.92 CHEK1 (0.51) CHEK1KMT2ANPC1POLBRAB9A
SCHEMBL4722967 0.91 CHEK1 (0.50) CHEK1KMT2ANPC1POLBRAB9A
SCHEMBL4722959 0.91 CHEK1 (0.50) CHEK1KMT2ANPC1POLBRAB9A
SCHEMBL4723744 0.90 RAB9A (0.50) CHEK1KMT2ANPC1POLBRAB9A
SCHEMBL4724177 0.90 RAB9A (0.51) CHEK1KMT2ANPC1POLBRAB9A
SCHEMBL5089748 0.90 RAB9A (0.51) CHEK1KMT2ANPC1POLBRAB9A
SCHEMBL4879940 0.90 CHEK1 (0.49) CHEK1KMT2ANPC1POLBRAB9A

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
US-7371862-B2 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2008-05-13 US claimed
US-20070112020-A1 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PHARMACIA ITALIA S.P.A. (IT) 2007-05-17 US claimed
US-7371862-B2 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2008-05-13 US disclosed
US-20070112020-A1 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PHARMACIA ITALIA S.P.A. (IT) 2007-05-17 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-20070112020-A1 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K20, MAP3K6, MAP3K1 CHEK1 251/4885KMT2A 1112/4885NPC1 2118/4885

“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.