SCHEMBL12836718

SCHEMBL12836718

CCc1ccccc1-c1c[nH]c2ncc(-c3ccc(NS)cc3)cc12

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SGK1 O00141 7/20 0.59
▸ CAMKK2 Q96RR4 5/20 0.59
▸ CCNT1 O60563 1/20 0.57
▸ CCNA2 P20248 1/20 0.57
▸ CDK2 P24941 1/20 0.57
▸ CDK9 P50750 1/20 0.57
▸ AXL P30530 3/20 0.52
▸ CDK8 P49336 1/20 0.52
▸ TNIK Q9UKE5 1/20 0.52
▸ CLK1 P49759 4/20 0.48
▸ DYRK1A Q13627 4/20 0.48
▸ DYRK2 Q92630 4/20 0.48
▸ DYRK1B Q9Y463 4/20 0.48
▸ PDPK1 O15530 1/20 0.48
▸ KIT P10721 1/20 0.47

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
SCHEMBL1516737 0.86 DYRK1A (0.66) SGK1CAMKK2CCNT1CCNA2CDK2
SCHEMBL12763444 0.86 CLK1 (0.67) SGK1CAMKK2CCNT1CCNA2CDK2
SCHEMBL12763441 0.85 CCNT1 (0.60) SGK1CAMKK2CCNT1CCNA2CDK2
SCHEMBL1516683 0.81 PDPK1 (0.62) SGK1CAMKK2CCNT1CCNA2CDK2
SCHEMBL12763381 0.80 SGK1 (0.59) SGK1CAMKK2CCNT1CCNA2CDK2
SCHEMBL12763489 0.79 MAP3K11 (0.69) SGK1CAMKK2CCNT1CCNA2CDK2
SCHEMBL12762896 0.79 TNIK (0.54) SGK1CAMKK2CCNT1CCNA2CDK2
SCHEMBL1516696 0.79 CDK2 (0.61) SGK1CAMKK2CCNT1CCNA2CDK2
SCHEMBL1516641 0.79 CCNT1 (0.59) SGK1CAMKK2CCNT1CCNA2CDK2
SCHEMBL12836890 0.78 AXL (0.50) SGK1CCNT1CCNA2CDK2CDK9

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-7906648-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2011-03-15 — — US disclosed
US-7709645-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2010-05-04 — — US disclosed
US-20090306056-A1 PYRROLO-PYRIDINE KINASE MODULATORS SGX PHARMACEUTICALS, INC. 2009-12-10 — — US disclosed
US-7582637-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2009-09-01 — — US disclosed
US-20090143352-A1 PYRROLO-PYRIDINE KINASE MODULATIORS SGX PHARMACEUTICALS, INC. (US) 2009-06-04 — — US disclosed
US-20080221119-A1 PYRROLO-PYRIDINE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-09-11 — — US disclosed
US-7361763-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2008-04-22 — — US disclosed
US-7361764-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2008-04-22 — — 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 (3 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-20090306056-A1 PYRROLO-PYRIDINE KINASE MODULATORS MAP3K20, MAP4K2, MAP3K19 SGK1 278/4885CAMKK2 31/4885CCNT1 2089/4885
US-20080221119-A1 PYRROLO-PYRIDINE KINASE MODULATORS MAP3K20, MAP4K2, MAP3K19 SGK1 278/4885CAMKK2 31/4885CCNT1 2089/4885
US-20090143352-A1 PYRROLO-PYRIDINE KINASE MODULATIORS MAP4K2, PDXK, MAP4K1 SGK1 265/4885CAMKK2 37/4885CCNT1 1089/4885

“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.

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