SCHEMBL2715519

SCHEMBL2715519

Cc1cc(Nc2cc(NC(CC3CC3)C(N)=O)c(F)cc2C(N)=O)sn1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BTK Q06187 5/20 0.33
JAK3 P52333 4/20 0.33
LCK P06239 3/20 0.33
ROCK2 O75116 1/20 0.33
SYK P43405 3/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
CNR2 P34972 3/20 0.32
CD38 P28907 1/20 0.31
CNR1 P21554 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
MAP2K2 P36507 1/20 0.30
MAP2K1 Q02750 1/20 0.30

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
SCHEMBL2715508 1.00 BTK (0.33) BTKJAK3LCKROCK2SYK
SCHEMBL9109019 0.87 SYK (0.35) BTKJAK3LCKSYKIRAK4
SCHEMBL9109057 0.87 SYK (0.35) BTKJAK3LCKSYKIRAK4
SCHEMBL2713070 0.86 JAK2 (0.33) BTKJAK3LCKIRAK4CNR2
SCHEMBL2713073 0.86 JAK2 (0.33) BTKJAK3LCKIRAK4CNR2
SCHEMBL2716876 0.85 SYK (0.40) SYK
SCHEMBL10272242 0.85 BTK (0.33) BTKJAK3LCKSYKIRAK4
SCHEMBL19901787 0.85 BTK (0.33) BTKJAK3LCKSYKIRAK4
SCHEMBL2716898 0.85 SYK (0.40) SYK
SCHEMBL2728855 0.85 BTK (0.37) BTKJAK3LCKROCK2SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9359375-B2 Benzamides and nicotinamides as Syk modulators PORTOLA PHARMACEUTICALS, INC. (US) 2016-06-07 US claimed
US-20150038492-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS ALEXION PHARMACEUTICALS, INC. 2015-02-05 US claimed
US-8846928-B2 Benzamides and nicotinamides as Syk modulators PORTOLA PHARMACEUTICALS, INC. (US) 2014-09-30 US claimed
EP-2635556-A2 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS Portola Pharmaceuticals, Inc. (US) 2013-09-11 EP claimed
WO-2012061418-A2 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 WO claimed
WO-2018195471-A1 SYK INHIBITORS IN COMBINATION WITH HYPOMETHYLATING AGENTS GILEAD SCIENCES, INC. (US) 2018-10-25 WO disclosed
US-20180071303-A1 SYK INHIBITORS Kronos Bio, Inc. 2018-03-15 US disclosed
US-9902688-B2 Benzamides and nicotinamides as Syk modulators PORTOLA PHARMACEUTICALS, INC. (US) 2018-02-27 US disclosed
EP-3176154-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS Portola Pharmaceuticals, Inc. (US) 2017-06-07 EP disclosed
US-20160318852-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS ALEXION PHARMACEUTICALS, INC. 2016-11-03 US disclosed
US-9359375-B2 Benzamides and nicotinamides as Syk modulators PORTOLA PHARMACEUTICALS, INC. (US) 2016-06-07 US disclosed
US-20150038492-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS ALEXION PHARMACEUTICALS, INC. 2015-02-05 US disclosed
US-8846928-B2 Benzamides and nicotinamides as Syk modulators PORTOLA PHARMACEUTICALS, INC. (US) 2014-09-30 US disclosed
EP-2635556-A2 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS Portola Pharmaceuticals, Inc. (US) 2013-09-11 EP disclosed
US-20120142671-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-06-07 US disclosed
WO-2012061418-A2 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 WO 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-20120142671-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS SYK, BTK, NADK BTK 2/4885JAK3 258/4885LCK 25/4885
US-20160318852-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS SYK, BTK, NADK BTK 2/4885JAK3 258/4885LCK 25/4885
US-20180071303-A1 SYK INHIBITORS SYK, LCK, MERTK BTK 6/4885JAK3 24/4885LCK 2/4885
US-20150038492-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS SYK, BTK, NADK BTK 2/4885JAK3 258/4885LCK 25/4885

“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.