SCHEMBL973154

SCHEMBL973154

CSc1nccc(-c2cccnc2Oc2ccc(N=C=S)nc2)n1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 1/20 0.36
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
CDK9 P50750 1/20 0.36
CCNA1 P78396 1/20 0.36
CDK5 Q00535 1/20 0.36
CDK5R1 Q15078 1/20 0.36
APLNR P35414 1/20 0.36
LMNA P02545 1/20 0.35
TEK Q02763 2/20 0.35
AURKB Q96GD4 4/20 0.33
AURKA O14965 3/20 0.33
TPX2 Q9ULW0 3/20 0.33
PDE10A Q9Y233 3/20 0.33

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
SCHEMBL972301 0.86 TEK (0.38) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL971925 0.81 CCNT1 (0.39) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL972302 0.81 LMNA (0.43) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL581233 0.78 AURKB (0.41) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL29891225 0.75 TUBB4A (0.44) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL972134 0.68 TEK (0.42) TEKAURKBAURKAPDE10A
SCHEMBL4482372 0.66 CYP11B1 (0.51) APLNRLMNA
SCHEMBL3576830 0.66 LMNA (0.50) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL4668256 0.66 AURKA (0.38) TEKAURKBAURKATPX2PDE10A
SCHEMBL21908973 0.65 LMNA (0.36) CCNT1CCNA2CDK2CDK9CCNA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7868177-B2 Multi-cyclic compounds and method of use AMGEN INC. (US) 2011-01-11 US disclosed
EP-1994030-B1 MULTI-CYCLIC COMPOUNDS AND METHOD OF USE AMGEN INC (US) 2010-08-25 EP disclosed
EP-1994030-A1 MULTI-CYCLIC COMPOUNDS AND METHOD OF USE Amgen Inc. (US) 2008-11-26 EP disclosed
US-20070213325-A1 Multi-cyclic compound and method of use AMGEN INC. (US) 2007-09-13 US disclosed
WO-2007100646-A1 MULTI-CYCLIC COMPOUNDS AND METHOD OF USE AMGEN INC. (US) 2007-09-07 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-20070213325-A1 Multi-cyclic compound and method of use TIE1, CDK1, CCNB1 CCNT1 48/4885CCNA2 19/4885CDK2 4/4885

“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.