SCHEMBL352799

SCHEMBL352799

c1nc2nc(Nc3ccc4[nH]ccc4c3)[nH]c(NC3CC4CCC3C4)c-2n1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.39
JAK1 P23458 2/20 0.39
ULK1 O75385 1/20 0.36
EGFR P00533 8/20 0.36
FLT1 P17948 6/20 0.36
SYK P43405 1/20 0.35
S1PR1 P21453 1/20 0.35
ADORA3 P0DMS8 2/20 0.34
ADORA2A P29274 2/20 0.34
ADORA1 P30542 2/20 0.34
GPR183 P32249 1/20 0.34
KDR P35968 2/20 0.34
JAK3 P52333 1/20 0.33
IGF1R P08069 1/20 0.32
HRH4 Q9H3N8 1/20 0.31
EPHX1 P07099 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL351556 0.81 ADORA2A (0.37) JAK2JAK1EGFRADORA3ADORA2A
SCHEMBL352309 0.80 SYK (0.42) ULK1EGFRFLT1SYKS1PR1
SCHEMBL352615 0.79 PDE9A (0.40) EGFRADORA3ADORA2AADORA1GPR183
SCHEMBL351023 0.79 ADORA3 (0.45) JAK2JAK1SYKADORA3ADORA2A
SCHEMBL370217 0.78 ADORA3 (0.34) JAK2JAK1ADORA3ADORA2AADORA1
SCHEMBL350165 0.78 TNNI3K (0.38) JAK2JAK1ADORA3ADORA2AADORA1
SCHEMBL351991 0.77 ALDH1A1 (0.35) JAK2JAK1SYKADORA3ADORA2A
SCHEMBL349700 0.75 IRAK4 (0.42) JAK2EGFRFLT1SYKKDR
SCHEMBL349701 0.75 IRAK4 (0.42) JAK2EGFRFLT1SYKKDR
SCHEMBL4428827 0.74 EGFR (0.50) EGFRFLT1SYKKDRNPC1

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
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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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 JAK2 4/4885JAK1 5/4885ULK1 280/4885
US-20100069369-A1 Kinase Inhibitors And Their Uses BTK, SYK, JAK2 JAK2 3/4885JAK1 4/4885ULK1 473/4885

“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.