SCHEMBL5481231

SCHEMBL5481231

O=C(Nc1cccc(-c2cn3ccnc3c(-n3ccnc3-c3ccccc3)n2)c1)c1ccc(F)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.59
SYK P43405 3/20 0.55
EPHB4 P54760 5/20 0.53
POLB P06746 2/20 0.52
RAB9A P51151 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 2/20 0.52
LMNA P02545 2/20 0.52
GFER P55789 1/20 0.52
ALDH1A1 P00352 3/20 0.52
MAPK1 P28482 2/20 0.52
HPGD P15428 1/20 0.52
TP53 P04637 1/20 0.51
PKM P14618 1/20 0.51
HSD17B10 Q99714 1/20 0.51
TMIGD3 P0DMS9 3/20 0.49
ADORA3 P0DMS8 1/20 0.49
AURKA O14965 2/20 0.48
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL5482107 0.94 POLB (0.56) BTKSYKEPHB4POLBRAB9A
SCHEMBL5477799 0.94 BTK (0.61) BTKSYKEPHB4POLBRAB9A
SCHEMBL5480930 0.91 BTK (0.59) BTKSYKEPHB4POLBRAB9A
SCHEMBL5482708 0.86 BTK (0.54) BTKSYKEPHB4POLBRAB9A
SCHEMBL5477850 0.85 SYK (0.56) BTKSYKEPHB4POLBKDM4E
SCHEMBL5483360 0.85 AURKA (0.56) BTKSYKEPHB4POLBSMN1; SMN2
SCHEMBL5479920 0.83 HIF1A (0.52) BTKSYKEPHB4POLBRAB9A
SCHEMBL5478329 0.82 EPHB4 (0.56) EPHB4POLBRAB9AKDM4EALDH1A1
SCHEMBL5484746 0.81 EPHB4 (0.58) EPHB4POLBRAB9ASMN1; SMN2KDM4E
SCHEMBL5481019 0.81 SYK (0.53) BTKSYKEPHB4POLBRAB9A

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 7 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
WO-2004072080-A1 CERTAIN 8-HETEROARYL-6-PHENYL-IMIDAZO[1,2-A]PYRAZINES AS MODULATORS OF HSP90 COMPLEX ACTIVITY CELLULAR GENOMICS, INC. (US) 2004-08-26 WO 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 BTK 380/4885SYK 778/4885EPHB4 4724/4885

“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.