SCHEMBL12423148

SCHEMBL12423148

Cc1cc(C)cc(Nc2nccc(-c3ccc(Br)s3)n2)c1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 11/20 0.61
SYK P43405 11/20 0.61
SRC P12931 9/20 0.61
CDK2 P24941 6/20 0.61
PIK3CA P42336 1/20 0.50
PIK3CG P48736 1/20 0.50
GSK3B P49841 2/20 0.49
CDK4 P11802 2/20 0.49
IKBKB O14920 1/20 0.48
DKK1 O94907 1/20 0.48
KDR P35968 4/20 0.46
AURKA O14965 1/20 0.44
CDK1 P06493 1/20 0.44
CDK7 P50613 1/20 0.44
CDK9 P50750 1/20 0.44
ABL1 P00519 1/20 0.44
BCR P11274 1/20 0.44

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
SCHEMBL12423167 0.88 PIK3CG (0.66) ZAP70SYKSRCCDK2PIK3CA
SCHEMBL12423171 0.88 IKBKB (0.55) ZAP70SYKSRCCDK2PIK3CA
SCHEMBL12423159 0.84 IKBKB (0.49) ZAP70SYKSRCCDK2PIK3CA
SCHEMBL13181310 0.84 ZAP70 (0.61) ZAP70SYKSRCCDK2PIK3CA
SCHEMBL14216198 0.82 ZAP70 (0.77) ZAP70SYKSRCCDK2PIK3CA
SCHEMBL12423174 0.80 KMT2A (0.53) CDK2PIK3CAPIK3CGGSK3BCDK4
SCHEMBL12423172 0.80 PIK3CG (0.52) ZAP70SYKSRCCDK2PIK3CA
SCHEMBL12423166 0.80 SYK (0.58) SYKCDK2PIK3CAPIK3CGGSK3B
SCHEMBL12423144 0.79 PIK3CB (0.58) ZAP70SYKSRCCDK2PIK3CA
SCHEMBL12423136 0.79 CDK2 (0.50) SYKCDK2PIK3CAPIK3CGGSK3B

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 ZAP70 360/4885SYK 420/4885SRC 259/4885
US-20070117800-A1 PYRIMIDINYL-THIOPHENE KINASE MODULATORS MAP3K20, MAP3K6, MAP4K2 ZAP70 360/4885SYK 420/4885SRC 259/4885

“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.