SCHEMBL10128490

SCHEMBL10128490

CS(=O)(=O)c1ccc(Nc2nc(NCC3(N)CCCCC3)[nH]c(=O)c2C(N)=O)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.38
GRM4 Q14833 1/20 0.37
BCDIN3D Q7Z5W3 8/20 0.35
JAK2 O60674 2/20 0.32
JAK1 P23458 2/20 0.32
GCK P35557 3/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 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
SCHEMBL10128744 0.91 SYK (0.38) SYKBCDIN3DJAK2JAK1MAPT
SCHEMBL10128419 0.87 SYK (0.39) SYKGRM4BCDIN3DGCK
SCHEMBL10128219 0.86 JAK2 (0.43) SYKJAK2JAK1
SCHEMBL10128745 0.85 MAPT (0.41) SYKJAK2JAK1MAPTTHRB
SCHEMBL10128414 0.85 SYK (0.38) SYKBCDIN3D
SCHEMBL10128214 0.85 EML4 (0.43) SYKBCDIN3DJAK2JAK1
SCHEMBL10128469 0.84 SYK (0.39) SYKBCDIN3DJAK2
SCHEMBL16305357 0.84 SYK (0.38) SYKBCDIN3D
SCHEMBL10157291 0.83 SYK (0.41) SYKBCDIN3DMAPTTHRB
SCHEMBL10158084 0.83 SYK (0.36) SYKBCDIN3D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9487491-B2 Diamino heterocyclic carboxamide compound ASTELLAS PHARMA INC. (JP) 2016-11-08 US disclosed
US-9487491-B2 Diamino heterocyclic carboxamide compound ASTELLAS PHARMA INC. (JP) 2016-11-08 US disclosed
US-8969336-B2 Diamino heterocyclic carboxamide compound ASTELLAS PHARMA INC. (JP) 2015-03-03 US disclosed
US-8969336-B2 Diamino heterocyclic carboxamide compound ASTELLAS PHARMA INC. (JP) 2015-03-03 US disclosed
US-20140371196-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2014-12-18 US disclosed
US-20140371196-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2014-12-18 US disclosed
US-20120040968-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND WATERS TECHNOLOGIES CORPORATION (US) 2012-02-16 US disclosed
US-20120040968-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND WATERS TECHNOLOGIES CORPORATION (US) 2012-02-16 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-20140371196-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND EML4, ALK, ERBB4 SYK 2200/4885GRM4 912/4885BCDIN3D 274/4885
US-20120040968-A1 DIAMINO HETEROCYCLIC CARBOXAMIDE COMPOUND EML4, ALK, ERBB4 SYK 2200/4885GRM4 912/4885BCDIN3D 274/4885

“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.