SCHEMBL8510423

SCHEMBL8510423

CN1CCC(Oc2ccc(N=C3NC(=O)C(=Cc4c[nH]c5ncncc45)S3)c(Cl)c2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
RNASEL Q05823 1/20 0.38
DYRK3 O43781 3/20 0.36
WEE1 P30291 1/20 0.35
DYRK1B Q9Y463 2/20 0.34
MEN1 O00255 2/20 0.34
POLB P06746 2/20 0.34
KMT2A Q03164 2/20 0.34
GALR3 O60755 1/20 0.34
USP2 O75604 1/20 0.34
IGF1R P08069 1/20 0.34
TTK P33981 1/20 0.34
GSK3B P49841 2/20 0.34
CSNK1E P49674 1/20 0.34
CLK1 P49759 1/20 0.34
CLK2 P49760 1/20 0.34
CLK3 P49761 1/20 0.34
DYRK1A Q13627 1/20 0.34
DYRK2 Q92630 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34

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
SCHEMBL249815 1.00 HPGD (0.41) HPGDRNASELDYRK3WEE1DYRK1B
SCHEMBL8510897 0.96 HPGD (0.38) HPGDRNASELDYRK3DYRK1BMEN1
SCHEMBL8510894 0.96 HPGD (0.38) HPGDRNASELDYRK3DYRK1BMEN1
SCHEMBL8511185 0.93 MAPT (0.40) HPGDRNASELDYRK1BMEN1POLB
SCHEMBL8511177 0.93 MAPT (0.40) HPGDRNASELDYRK1BMEN1POLB
SCHEMBL252658 0.89 MAPT (0.40) HPGDRNASELMEN1POLBKMT2A
SCHEMBL252659 0.89 MAPT (0.40) HPGDRNASELMEN1POLBKMT2A
SCHEMBL250167 0.89 DYRK3 (0.43) HPGDRNASELDYRK3DYRK1BMEN1
SCHEMBL250166 0.89 DYRK3 (0.43) HPGDRNASELDYRK3DYRK1BMEN1
SCHEMBL8514561 0.87 SOS1 (0.37) HPGDDYRK3MAPTRECQLNPSR1

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
US-20120135989-A1 AZAINDOLE DERIVATIVE CRYSTALGENOMICS, INC. (KR) 2012-05-31 US claimed
US-20120135989-A1 AZAINDOLE DERIVATIVE CRYSTALGENOMICS, INC. (KR) 2012-05-31 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-20120135989-A1 AZAINDOLE DERIVATIVE CDC7, CDCA2, CDC5L HPGD 4159/4885RNASEL 2872/4885DYRK3 1263/4885

“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.