SCHEMBL12423664

SCHEMBL12423664

O=Cc1cccc(Nc2nccc(-c3ccc(C(=O)NCc4cccc(Cl)c4)s3)n2)c1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AKT3 Q9Y243 11/20 0.59
CNR2 P34972 3/20 0.47
DYRK1A Q13627 1/20 0.45
DYRK1B Q9Y463 1/20 0.45
ABL1 P00519 2/20 0.45
BCR P11274 2/20 0.45
CAMK2D Q13557 1/20 0.44
CDK4 P11802 1/20 0.44
CDK2 P24941 1/20 0.44
PRKCA P17252 1/20 0.43
PRKCD Q05655 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL14526737 0.90 AKT3 (0.48) AKT3DYRK1ADYRK1B
SCHEMBL12509343 0.90 AKT3 (0.50) AKT3ABL1BCRCDK2
SCHEMBL12423662 0.89 AKT3 (0.61) AKT3CNR2DYRK1ADYRK1BABL1
SCHEMBL12423316 0.88 AKT3 (0.60) AKT3CNR2DYRK1ADYRK1BABL1
SCHEMBL12423663 0.87 AKT3 (0.60) AKT3CNR2DYRK1ADYRK1BABL1
SCHEMBL4927821 0.83 AKT3 (0.61) AKT3CNR2DYRK1ADYRK1BABL1
SCHEMBL4991070 0.83 AKT3 (0.82) AKT3PRKCA
SCHEMBL14619443 0.82 CDK2 (0.50) AKT3CDK2
SCHEMBL2196849 0.82 AKT3 (0.55) AKT3CNR2
SCHEMBL3097637 0.82 AKT3 (0.54) AKT3CNR2ABL1BCR

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 6 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-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
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 AKT3 340/4885CNR2 2660/4885DYRK1A 402/4885
US-20070117800-A1 PYRIMIDINYL-THIOPHENE KINASE MODULATORS MAP3K20, MAP3K6, MAP4K2 AKT3 340/4885CNR2 2660/4885DYRK1A 402/4885

“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.