SCHEMBL4367608

SCHEMBL4367608

COc1cccc(Nc2nc3cc(Oc4ccncc4)ccc3[nH]2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
RAF1 P04049 5/20 0.51
KDR P35968 1/20 0.49
BRAF P15056 4/20 0.45
ABCG2 Q9UNQ0 2/20 0.44
ABCB1 P08183 1/20 0.44
GAA P10253 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ABL1 P00519 1/20 0.44
CSNK1A1 P48729 1/20 0.43
CSNK1D P48730 1/20 0.43
GRM4 Q14833 1/20 0.42
PDE10A Q9Y233 1/20 0.42
ALDH1A1 P00352 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HTT P42858 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
SCHEMBL4369261 0.86 CSNK1A1 (0.54) MEN1KMT2ARAF1KDRBRAF
SCHEMBL4375547 0.85 KDR (0.53) RAF1KDRBRAFKDM4ECSNK1A1
SCHEMBL4370234 0.85 KDR (0.55) RAF1KDRBRAFKDM4ECSNK1A1
SCHEMBL4376917 0.83 BRAF (0.59) RAF1KDRBRAFABCG2CSNK1A1
SCHEMBL13209739 0.82 BRAF (0.69) RAF1KDRBRAF
SCHEMBL2886160 0.82 MAPT (0.46) MAPTMEN1KMT2ARAF1KDR
SCHEMBL4367856 0.81 KDR (0.55) RAF1KDRBRAFCSNK1A1CSNK1D
SCHEMBL2886163 0.81 RAF1 (0.47) MAPTMEN1KMT2ARAF1KDR
SCHEMBL1663431 0.80 MEN1 (0.57) MAPTMEN1KMT2AKDRABCG2
SCHEMBL4369908 0.80 KDR (0.56) MAPTRAF1KDRBRAFCSNK1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7531553-B2 Heterocyclic compounds and methods of use AMGEN INC. (US) 2009-05-12 US disclosed
US-7531553-B2 Heterocyclic compounds and methods of use AMGEN INC. (US) 2009-05-12 US disclosed
US-7531553-B2 Heterocyclic compounds and methods of use AMGEN INC. (US) 2009-05-12 US disclosed
EP-1638954-A1 FUSED AZOLES SUCH AS 2,5-DISUBSTITUTED BENZIMIDAZOLES, BENZOXAZOLES AND BENZOTHIAZOLES AS KINASE INHIBITORS AMGEN INC. (US) 2006-03-29 EP disclosed
US-20040209892-A1 Heterocyclic compounds and methods of use U.S. PATENT OPERATIONS 2004-10-21 US disclosed
WO-2004085425-A1 FUSED AZOLES SUCH AS 2,5-DISUBSTITUTED BENZIMIDAZOLES, BENZOXAZOLES AND BENZOTHIAZOLES AS KINASE INHIBITORS AMGEN INC (US) 2004-10-07 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-20040209892-A1 Heterocyclic compounds and methods of use VHL, NQO1, HPGDS MAPT 3455/4885MEN1 808/4885KMT2A 3750/4885

“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.