SCHEMBL351556

SCHEMBL351556

Cc1cccc(Nc2nc3ncnc-3c(NC3CC4CCC3C4)[nH]2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.37
ADORA3 P0DMS8 1/20 0.37
ADORA1 P30542 1/20 0.37
GPR183 P32249 1/20 0.37
EGFR P00533 4/20 0.37
ABL1 P00519 1/20 0.37
ABL2 P42684 1/20 0.37
GABBR2 O75899 3/20 0.34
GABBR1 Q9UBS5 3/20 0.34
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
PDGFRB P09619 3/20 0.33
PDGFRA P16234 3/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
GFER P55789 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL352615 0.88 PDE9A (0.40) ADORA2AADORA3ADORA1GPR183EGFR
SCHEMBL351991 0.86 ALDH1A1 (0.35) ADORA2AADORA3ADORA1GPR183JAK2
SCHEMBL350165 0.85 TNNI3K (0.38) ADORA2AADORA3ADORA1GPR183JAK2
SCHEMBL352799 0.81 JAK2 (0.39) ADORA2AADORA3ADORA1GPR183EGFR
SCHEMBL352724 0.79 SYK (0.37) EGFRABL1ABL2JAK2PDGFRB
SCHEMBL351023 0.79 ADORA3 (0.45) ADORA2AADORA3ADORA1GPR183JAK2
SCHEMBL370217 0.78 ADORA3 (0.34) ADORA2AADORA3ADORA1GPR183JAK2
SCHEMBL8798429 0.75 EGFR (0.49) ADORA2AADORA3ADORA1GPR183EGFR
SCHEMBL4763191 0.74 IRAK4 (0.48) IRAK4
SCHEMBL4414428 0.73 EGFR (0.47) ADORA2AEGFRABL1ABL2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1960372-B1 KINASE INHIBITORS AND THEIR USES RIGEL PHARMACEUTICALS INC (US) 2015-12-09 EP claimed
EP-1960372-A1 KINASE INHIBITORS AND THEIR USES Rigel Pharmaceuticals, Inc. (US) 2008-08-27 EP claimed
WO-2007070872-A1 KINASE INHIBITORS AND THEIR USES RIGEL PHARMACEUTICALS, INC. (US) 2007-06-21 WO claimed
US-20070142402-A1 Kinase Inhibitors And Their Uses RIGEL PHARMACEUTICALS, INC. (US) 2007-06-21 US claimed
US-9834568-B2 Kinase inhibitors and their uses RIGEL PHARMACEUTICALS, INC. (US) 2017-12-05 US disclosed
US-20160024116-A1 Kinase Inhibitors And Their Uses MIDCAP FINANCIAL TRUST 2016-01-28 US disclosed
EP-1960372-B1 KINASE INHIBITORS AND THEIR USES RIGEL PHARMACEUTICALS INC (US) 2015-12-09 EP disclosed
US-9096542-B2 Kinase inhibitors and their uses RIGEL PHARMACEUTICALS, INC. (US) 2015-08-04 US disclosed
US-20120015937-A1 Kinase Inhibitors And Their Uses RIGEL PHARMACEUTICALS, INC. (US) 2012-01-19 US disclosed
US-8053434-B2 Kinase inhibitors and their uses RIGEL PHARMACEUTICALS, INC. (US) 2011-11-08 US disclosed
US-20100069369-A1 Kinase Inhibitors And Their Uses RIGEL PHARMACEUTICALS, INC. (US) 2010-03-18 US disclosed
US-7601713-B2 Kinase inhibitors and their uses RIGEL PHARMACEUTICALS, INC. (US) 2009-10-13 US disclosed
US-20070142402-A1 Kinase Inhibitors And Their Uses RIGEL PHARMACEUTICALS, INC. (US) 2007-06-21 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 (4 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-20120015937-A1 Kinase Inhibitors And Their Uses BTK, SYK, LYN ADORA2A 3008/4885ADORA3 3723/4885ADORA1 4194/4885
US-20160024116-A1 Kinase Inhibitors And Their Uses BTK, SYK, LYN ADORA2A 3008/4885ADORA3 3723/4885ADORA1 4194/4885
US-20100069369-A1 Kinase Inhibitors And Their Uses BTK, SYK, JAK2 ADORA2A 2362/4885ADORA3 3029/4885ADORA1 3082/4885
US-20070142402-A1 Kinase Inhibitors And Their Uses BTK, SYK, LYN ADORA2A 3008/4885ADORA3 3723/4885ADORA1 4194/4885

“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.