Sugi Predict

Sugi Predict / Compounds / SCHEMBL12423714

SCHEMBL12423714

SCHEMBL12423714

CNC(=O)c1csc(-c2ccnc(Nc3cccc(C(C)O)c3)n2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CAMK2D Q13557 6/20 0.52
▸ IKBKB O14920 1/20 0.44
▸ BRAF P15056 1/20 0.44
▸ CDK2 P24941 2/20 0.43
▸ CCNT1 O60563 1/20 0.42
▸ CDK1 P06493 1/20 0.42
▸ CCNB1 P14635 1/20 0.42
▸ CCNA2 P20248 1/20 0.42
▸ CDK7 P50613 1/20 0.42
▸ CDK9 P50750 1/20 0.42
▸ CCNH P51946 1/20 0.42
▸ CCNA1 P78396 1/20 0.42
▸ ABL1 P00519 7/20 0.41
▸ BCR P11274 6/20 0.41
▸ SRC P12931 5/20 0.41
▸ PRKCA P17252 4/20 0.41
▸ PDGFRB P09619 4/20 0.41
▸ PDGFRA P16234 4/20 0.41
▸ PRKCD Q05655 3/20 0.41
▸ SCN9A Q15858 1/20 0.41

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
SCHEMBL12423716 0.91 STK17A (0.46) CAMK2DIKBKBBRAFABL1BCR
SCHEMBL2198087 0.90 CAMK2D (0.43) CAMK2DIKBKBABL1BCRSRC
SCHEMBL12423713 0.90 CAMK2D (0.43) CAMK2DIKBKBCDK2ABL1BCR
SCHEMBL12423725 0.88 CAMK2D (0.44) CAMK2DIKBKBCDK2ABL1BCR
SCHEMBL12423719 0.87 CAMK2D (0.45) CAMK2DIKBKBABL1BCRSRC
SCHEMBL12423718 0.86 CAMK2D (0.43) CAMK2DIKBKBCDK2CCNT1CDK1
SCHEMBL12423724 0.86 ROCK2 (0.43) CAMK2DIKBKBABL1BCRSRC
SCHEMBL12423448 0.86 CAMK2D (0.58) CAMK2DIKBKBCDK2CCNT1CDK1
SCHEMBL12423728 0.85 CAMK2D (0.43) CAMK2DIKBKBCDK2CCNT1CDK1
SCHEMBL12423731 0.84 IKBKB (0.52) CAMK2DIKBKBCDK2CCNT1CDK1

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 CAMK2D 313/4885IKBKB 553/4885BRAF 210/4885
US-20070117800-A1 PYRIMIDINYL-THIOPHENE KINASE MODULATORS MAP3K20, MAP3K6, MAP4K2 CAMK2D 313/4885IKBKB 553/4885BRAF 210/4885

“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.