SCHEMBL12423232

SCHEMBL12423232

CC(O)c1cccc(Nc2nccc(-c3ccc(C(=O)N(C)CCc4ccccc4)s3)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AKT3 Q9Y243 6/20 0.47
IKBKB O14920 4/20 0.43
LMNA P02545 1/20 0.41
CAMK2D Q13557 3/20 0.41
SYK P43405 2/20 0.41
CDK19 Q9BWU1 2/20 0.41
EGFR P00533 1/20 0.41
ERBB2 P04626 1/20 0.41
IGF1R P08069 1/20 0.41
PTK2 Q05397 1/20 0.41
CHUK O15111 2/20 0.40
IKBKG Q9Y6K9 2/20 0.40
ALK Q9UM73 1/20 0.40
SCN9A Q15858 1/20 0.39
MAPK8 P45983 1/20 0.38
PIK3CG P48736 1/20 0.38
GSK3B P49841 1/20 0.38
CAMKK2 Q96RR4 1/20 0.38

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
SCHEMBL12423257 0.92 HSD17B2 (0.46) AKT3IKBKBCAMK2DSYKEGFR
SCHEMBL12423221 0.90 AKT3 (0.43) AKT3IKBKBCAMK2DSYKCDK19
SCHEMBL12423233 0.88 IKBKB (0.43) AKT3IKBKBCAMK2DSYKCDK19
SCHEMBL12423234 0.87 IKBKB (0.43) AKT3IKBKBLMNACAMK2DSYK
SCHEMBL12423212 0.86 IKBKB (0.43) AKT3IKBKBLMNACAMK2DSYK
SCHEMBL12423250 0.86 AKT3 (0.67) AKT3IKBKBLMNACAMK2DCHUK
SCHEMBL12423269 0.85 JAK2 (0.44) AKT3IKBKBCAMK2DSYKCHUK
SCHEMBL12423296 0.85 CDK2 (0.44) AKT3IKBKBCAMK2DSYKCHUK
SCHEMBL12423224 0.85 IKBKB (0.41) AKT3IKBKBCAMK2DSYKCDK19
SCHEMBL12423248 0.84 IKBKB (0.43) AKT3IKBKBCAMK2DSYK

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-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

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 340/4885IKBKB 553/4885LMNA 4782/4885
US-20070117800-A1 PYRIMIDINYL-THIOPHENE KINASE MODULATORS MAP3K20, MAP3K6, MAP4K2 AKT3 340/4885IKBKB 553/4885LMNA 4782/4885

“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.