SCHEMBL5483360

SCHEMBL5483360

COc1cccc(C(=O)Nc2cccc(-c3cn4ccnc4c(-n4ccnc4-c4ccccc4)n3)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 3/20 0.56
SYK P43405 6/20 0.56
THRB P10828 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
EPHB4 P54760 1/20 0.54
POLB P06746 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
BTK Q06187 1/20 0.54
TMIGD3 P0DMS9 2/20 0.54
TP53 P04637 2/20 0.52
MAPT P10636 2/20 0.52
LMNA P02545 2/20 0.52
ALDH1A1 P00352 2/20 0.51
ALOX15 P16050 1/20 0.51
TSHR P16473 1/20 0.51
HSD17B10 Q99714 1/20 0.51
HPGD P15428 1/20 0.51
MAPK1 P28482 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL5477644 0.95 THRB (0.54) AURKASYKTHRBTDP1EPHB4
SCHEMBL5477799 0.91 BTK (0.61) AURKASYKEPHB4POLBKMT2A
SCHEMBL5477850 0.89 SYK (0.56) AURKASYKTHRBTDP1EPHB4
SCHEMBL5480930 0.85 BTK (0.59) AURKASYKTDP1EPHB4POLB
SCHEMBL5481231 0.85 BTK (0.59) AURKASYKEPHB4POLBKMT2A
SCHEMBL5482708 0.85 BTK (0.54) AURKASYKEPHB4POLBBTK
SCHEMBL5481019 0.84 SYK (0.53) AURKASYKEPHB4POLBBTK
SCHEMBL5482107 0.81 POLB (0.56) AURKASYKTHRBTDP1EPHB4
SCHEMBL5484746 0.80 EPHB4 (0.58) AURKAEPHB4POLBTP53MAPT
SCHEMBL5478193 0.80 EPHB4 (0.67) AURKASYKEPHB4BTK

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-7160885-B2 Certain 6, 8-(heteroaryl or aryl) disubstituted imidazo[1,2-a]pyrazines as modulators of Hsp90 complex activity CGI PHARMACEUTICALS, INC. (US) 2007-01-09 US claimed
US-20050054649-A1 Certain 8-heteroaryl-6-phenyl-imidazo[1,2-A]pyrazines as modulators of Hsp90 complex activity XEROX CORPORATION 2005-03-10 US claimed
US-7160885-B2 Certain 6, 8-(heteroaryl or aryl) disubstituted imidazo[1,2-a]pyrazines as modulators of Hsp90 complex activity CGI PHARMACEUTICALS, INC. (US) 2007-01-09 US disclosed
US-7160885-B2 Certain 6, 8-(heteroaryl or aryl) disubstituted imidazo[1,2-a]pyrazines as modulators of Hsp90 complex activity CGI PHARMACEUTICALS, INC. (US) 2007-01-09 US disclosed
US-7160885-B2 Certain 6, 8-(heteroaryl or aryl) disubstituted imidazo[1,2-a]pyrazines as modulators of Hsp90 complex activity CGI PHARMACEUTICALS, INC. (US) 2007-01-09 US disclosed
US-20050054649-A1 Certain 8-heteroaryl-6-phenyl-imidazo[1,2-A]pyrazines as modulators of Hsp90 complex activity XEROX CORPORATION 2005-03-10 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-20050054649-A1 Certain 8-heteroaryl-6-phenyl-imidazo[1,2-A]pyrazines as modulators of Hsp90 complex activity HSP90AB1, HSP90AA1, HSPA9 AURKA 2642/4885SYK 778/4885THRB 490/4885

“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.