SCHEMBL12423724

SCHEMBL12423724

CC(O)c1cccc(Nc2nccc(-c3cc(C(=O)NCc4ccncc4)cs3)n2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 2/20 0.43
GRK2 P25098 2/20 0.43
ABL1 P00519 7/20 0.42
SRC P12931 6/20 0.42
BCR P11274 5/20 0.42
PRKCA P17252 2/20 0.42
PRKCD Q05655 2/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
CNR2 P34972 1/20 0.41
CAMK2D Q13557 5/20 0.41
EGFR P00533 1/20 0.41
PDGFRB P09619 2/20 0.40
PDGFRA P16234 2/20 0.40
IKBKB O14920 2/20 0.40
CDC7 O00311 1/20 0.40
CDK19 Q9BWU1 1/20 0.40
TSHR P16473 1/20 0.39
PSMD14 O00487 1/20 0.39

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
SCHEMBL12423719 0.94 CAMK2D (0.45) ROCK2GRK2ABL1SRCBCR
SCHEMBL12423713 0.89 CAMK2D (0.43) ABL1SRCBCRPRKCAPRKCD
SCHEMBL2198087 0.89 CAMK2D (0.43) ABL1SRCBCRPRKCAPRKCD
SCHEMBL12423714 0.86 CAMK2D (0.52) ABL1SRCBCRPRKCAPRKCD
SCHEMBL12423716 0.85 STK17A (0.46) ROCK2ABL1SRCBCRPRKCA
SCHEMBL12997080 0.82 JAK2 (0.42) ABL1SRCBCRCAMK2DEGFR
SCHEMBL12423428 0.82 CAMK2D (0.49) ABL1SRCBCRPRKCAPRKCD
SCHEMBL12423725 0.82 CAMK2D (0.44) ABL1SRCBCRPRKCACAMK2D
SCHEMBL12423728 0.81 CAMK2D (0.43) ABL1SRCBCRPRKCACAMK2D
SCHEMBL12423308 0.80 AKT3 (0.54) CAMK2DIKBKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7977481-B2 Pyrimidinyl-thiophene kinase modulators SGX PHARMACEUTICALS, INC. (US) 2011-07-12 US disclosed
US-7977481-B2 Pyrimidinyl-thiophene kinase modulators SGX PHARMACEUTICALS, INC. (US) 2011-07-12 US disclosed
US-20100305128-A1 Pyrimidinyl-Thiophene Kinase Modulators ARNOLD WILLIAM D 2010-12-02 US disclosed
US-20100305128-A1 Pyrimidinyl-Thiophene Kinase Modulators ARNOLD WILLIAM D 2010-12-02 US disclosed
US-7803806-B2 Pyrimidinyl-thiophene kinase modulators SGX PHARMACEUTICALS, INC. (US) 2010-09-28 US disclosed
US-7803806-B2 Pyrimidinyl-thiophene kinase modulators SGX PHARMACEUTICALS, INC. (US) 2010-09-28 US disclosed
US-20070117800-A1 PYRIMIDINYL-THIOPHENE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2007-05-24 US disclosed
US-20070117800-A1 PYRIMIDINYL-THIOPHENE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2007-05-24 US disclosed
WO-2007053776-A1 PYRIMIDINYL-THIOPHENE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2007-05-10 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 (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-20100305128-A1 Pyrimidinyl-Thiophene Kinase Modulators MAP3K20, MAP3K6, MAP4K2 ROCK2 614/4885GRK2 49/4885ABL1 45/4885
US-20070117800-A1 PYRIMIDINYL-THIOPHENE KINASE MODULATORS MAP3K20, MAP3K6, MAP4K2 ROCK2 614/4885GRK2 49/4885ABL1 45/4885

“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.