SCHEMBL2481672

SCHEMBL2481672

Cc1nccn1-c1ccc(Nc2nc3c(c(N(CCC#N)C4CC4)n2)CN(C)CC3)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.35
CSNK2A2 P19784 1/20 0.33
JAK3 P52333 5/20 0.32
SYK P43405 1/20 0.32
JAK2 O60674 5/20 0.32
JAK1 P23458 2/20 0.32
TYK2 P29597 2/20 0.32
STAT3 P40763 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
PIK3CD O00329 1/20 0.31
PRKAB2 O43741 1/20 0.31
NUAK1 O60285 1/20 0.31
CCNT1 O60563 1/20 0.31
ABL1 P00519 1/20 0.31
FYN P06241 1/20 0.31
CDK1 P06493 1/20 0.31
CSF1R P07333 1/20 0.31

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
SCHEMBL2446673 0.89 CYP3A4 (0.37) ROCK2JAK3SYKJAK2JAK1
SCHEMBL2445540 0.86 SYK (0.32) CSNK2A2JAK3SYKJAK2JAK1
SCHEMBL2480660 0.86 MAPT (0.42) JAK3SYKJAK2MAPTCDK4
SCHEMBL2483876 0.81 JAK3 (0.41) ROCK2JAK3SYKNUAK1CDK1
SCHEMBL13355576 0.77 MAPT (0.43) SYKMAPTCDK4CCNA2CCND1
SCHEMBL8916274 0.76 SYK (0.35) SYKGPR119BRD4
SCHEMBL2509407 0.76 ROCK2 (0.42) ROCK2JAK3SYKJAK2KDM4E
SCHEMBL2449765 0.76 SYK (0.39) ROCK2JAK3SYKJAK2JAK1
SCHEMBL2480087 0.75 ROCK2 (0.41) ROCK2SYKMAPTEGFRCYP3A4
SCHEMBL2475554 0.74 SYK (0.44) JAK3SYKJAK2JAK1TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188101-B2 Dihydropyridopyrimidines for the treatment of AB-related pathologies ASTRAZENECA AB (SE) 2012-05-29 US claimed
EP-2367826-A1 MODULATORS OF AMYLOID BETA. AstraZeneca AB (SE) 2011-09-28 EP claimed
US-20100130495-A1 COMPOUNDS 563 ASTRAZENECA AB (SE) 2010-05-27 US claimed
WO-2010053438-A1 MODULATORS OF AMYLOID BETA. ASTRAZENECA AB (SE) 2010-05-14 WO claimed
US-8188101-B2 Dihydropyridopyrimidines for the treatment of AB-related pathologies ASTRAZENECA AB (SE) 2012-05-29 US disclosed
US-8188101-B2 Dihydropyridopyrimidines for the treatment of AB-related pathologies ASTRAZENECA AB (SE) 2012-05-29 US disclosed
US-8188101-B2 Dihydropyridopyrimidines for the treatment of AB-related pathologies ASTRAZENECA AB (SE) 2012-05-29 US disclosed
EP-2367826-A1 MODULATORS OF AMYLOID BETA. AstraZeneca AB (SE) 2011-09-28 EP disclosed
US-20100130495-A1 COMPOUNDS 563 ASTRAZENECA AB (SE) 2010-05-27 US disclosed
US-20100130495-A1 COMPOUNDS 563 ASTRAZENECA AB (SE) 2010-05-27 US disclosed
US-20100130495-A1 COMPOUNDS 563 ASTRAZENECA AB (SE) 2010-05-27 US disclosed
WO-2010053438-A1 MODULATORS OF AMYLOID BETA. ASTRAZENECA AB (SE) 2010-05-14 WO disclosed
WO-2010053438-A1 MODULATORS OF AMYLOID BETA. ASTRAZENECA AB (SE) 2010-05-14 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-20100130495-A1 COMPOUNDS 563 BACE1, PSEN1, PSEN2 ROCK2 445/4885CSNK2A2 2010/4885JAK3 3254/4885

“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.