SCHEMBL971925

SCHEMBL971925

CSc1nccc(-c2cccnc2Oc2ccc(N)nc2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 1/20 0.39
CCNA2 P20248 1/20 0.39
CDK2 P24941 1/20 0.39
CDK9 P50750 1/20 0.39
CCNA1 P78396 1/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39
FEN1 P39748 2/20 0.39
LMNA P02545 1/20 0.38
AURKA O14965 3/20 0.38
AURKB Q96GD4 3/20 0.38
MAPK14 Q16539 2/20 0.38
ULK1 O75385 1/20 0.38
RPS6KA5 O75582 1/20 0.38
RPS6KA4 O75676 1/20 0.38
PRKD3 O94806 1/20 0.38
ABL1 P00519 1/20 0.38
FES P07332 1/20 0.38
RET P07949 1/20 0.38
BCR P11274 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
SCHEMBL581233 0.87 AURKB (0.41) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL972302 0.86 LMNA (0.43) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL973154 0.81 CCNT1 (0.36) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL580264 0.81 TEK (0.55) AURKAAURKBTEKTPX2
SCHEMBL29891225 0.80 TUBB4A (0.44) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL972301 0.77 TEK (0.38) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL21908973 0.73 LMNA (0.36) CCNT1CCNA2CDK2CDK9CCNA1
SCHEMBL20497418 0.72 ERN1 (0.50) AURKAAURKBTEK
SCHEMBL20406679 0.72 PDE10A (0.48) FEN1LMNAPDE10A
SCHEMBL20497751 0.70 ERN1 (0.47) AURKAAURKBTEK

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.