SCHEMBL1356338

SCHEMBL1356338

Cc1ccc(S(=O)(=O)n2c(-c3cnn(C)c3)cc3c(C#N)c(Cl)cnc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 7/20 0.39
CCNA2 P20248 4/20 0.39
CCNK O75909 1/20 0.38
CDK12 Q9NYV4 1/20 0.38
CCNT1 O60563 3/20 0.36
CCNB2 O95067 3/20 0.36
CCNE2 O96020 3/20 0.36
CDK1 P06493 3/20 0.36
CCNB1 P14635 3/20 0.36
CCNE1 P24864 3/20 0.36
CDK9 P50750 3/20 0.36
CDK5 Q00535 3/20 0.36
CDK5R1 Q15078 3/20 0.36
CCNB3 Q8WWL7 3/20 0.36
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KIT P10721 2/20 0.35

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
SCHEMBL1354815 0.87 CDK2 (0.39) CDK2CCNA2CCNT1CCNB2CCNE2
SCHEMBL29285182 0.87 CCNA2 (0.37) CDK2CCNA2CCNKCDK12KIT
SCHEMBL29772856 0.83 KDM4E (0.39) CDK2CCNA2CCNT1CCNB2CCNE2
SCHEMBL30726626 0.81 KIT (0.41) CDK2CCNA2CCNT1CCNB2CCNE2
SCHEMBL1356637 0.81 CDK2 (0.36) CDK2CCNA2CCNKCDK12CCNT1
SCHEMBL1356633 0.80 CDK2 (0.36) CDK2CCNA2CCNT1CCNB2CCNE2
SCHEMBL1356639 0.80 CDK2 (0.36) CDK2CCNA2CCNT1CCNB2CCNE2
SCHEMBL30877452 0.80 CCNA2 (0.43) CDK2CCNA2CCNKCDK12KIT
SCHEMBL1356300 0.79 KIT (0.38) CDK2CCNA2CCNT1CCNB2CCNE2
SCHEMBL28569194 0.79 BTK (0.42) CDK2CCNT1CCNB2CCNE2CDK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2569316-B1 PYRROLOPYRIDINE AND PYRROLOPYRIMIDINE INHIBITORS OF KINASES ABBVIE INC (US) 2014-04-23 EP disclosed
EP-2569316-A1 PYRROLOPYRIDINE AND PYRROLOPYRIMIDINE INHIBITORS OF KINASES Abbvie Inc. (US) 2013-03-20 EP disclosed
US-20110281842-A1 PYRROLOPYRIDINE AND PYRROLOPYRIMIDINE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2011-11-17 US disclosed
WO-2011143459-A1 PYRROLOPYRIDINE AND PYRROLOPYRIMIDINE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2011-11-17 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 (1 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-20110281842-A1 PYRROLOPYRIDINE AND PYRROLOPYRIMIDINE INHIBITORS OF KINASES AURKA, AURKC, AURKB CDK2 12/4885CCNA2 138/4885CCNK 46/4885

“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.