SCHEMBL10171498

SCHEMBL10171498

COc1ccc(Nc2nc(NC3C4C=CC(C4)C3C(N)=O)c3nc[nH]c3n2)cc1S(N)(=O)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 6/20 0.49
AURKB Q96GD4 5/20 0.49
IRAK4 Q9NWZ3 11/20 0.47
ALK Q9UM73 5/20 0.45
MAP3K7 O43318 2/20 0.44
INSR P06213 2/20 0.43
AURKA O14965 2/20 0.43
LCK P06239 2/20 0.43
PDGFRA P16234 2/20 0.43
FLT3 P36888 2/20 0.43
SYK P43405 2/20 0.43
FGFR2 P21802 1/20 0.43
WEE1 P30291 1/20 0.43
GSK3B P49841 1/20 0.43
PRKCE Q02156 1/20 0.43
CDC7 O00311 1/20 0.43
PLK4 O00444 1/20 0.43
CHEK1 O14757 1/20 0.43
DCLK1 O15075 1/20 0.43
PDPK1 O15530 1/20 0.43

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
SCHEMBL10171469 0.91 IRAK4 (0.50) KDRAURKBIRAK4ALKMAP3K7
SCHEMBL10172029 0.85 KDR (0.54) KDRAURKBIRAK4ALKINSR
SCHEMBL10171214 0.85 KDR (0.51) KDRAURKBIRAK4ALKMAP3K7
SCHEMBL10171242 0.83 IRAK4 (0.55) KDRAURKBIRAK4ALKMAP3K7
SCHEMBL10171468 0.83 IRAK4 (0.55) IRAK4MAP3K7
SCHEMBL10171191 0.83 IRAK4 (0.55) IRAK4MAP3K7
SCHEMBL10171483 0.83 KDR (0.51) KDRAURKBIRAK4ALKMAP3K7
SCHEMBL10171480 0.82 IRAK4 (0.53) KDRAURKBIRAK4ALKMAP3K7
SCHEMBL10171241 0.82 KDR (0.50) KDRAURKBIRAK4ALKINSR
SCHEMBL10172001 0.81 IRAK4 (0.55) KDRAURKBIRAK4ALKMAP3K7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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-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-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-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
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 KDR 580/4885AURKB 233/4885IRAK4 239/4885
US-20160024116-A1 Kinase Inhibitors And Their Uses BTK, SYK, LYN KDR 580/4885AURKB 233/4885IRAK4 239/4885
US-20100069369-A1 Kinase Inhibitors And Their Uses BTK, SYK, JAK2 KDR 560/4885AURKB 265/4885IRAK4 293/4885
US-20070142402-A1 Kinase Inhibitors And Their Uses BTK, SYK, LYN KDR 580/4885AURKB 233/4885IRAK4 239/4885

“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.