SCHEMBL2447892

SCHEMBL2447892

CCN(CC1CCCO1)c1nc(Nc2ccc(-c3cnco3)cc2)nc2c1CNCC2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
TNK2 Q07912 8/20 0.34
SYK P43405 2/20 0.34
KCNH3 Q9ULD8 2/20 0.33
PKM P14618 1/20 0.33
ALDH1A1 P00352 3/20 0.32
MAPK1 P28482 3/20 0.32
HTT P42858 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MAPT P10636 2/20 0.32
RECQL P46063 2/20 0.32
BLM P54132 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
KMT2A Q03164 2/20 0.32
NPC1 O15118 1/20 0.32
GLA P06280 1/20 0.32
MAP4K1 Q92918 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL2446870 0.85 ROCK2 (0.36) TNK2SYKKCNH3PKMCHEK1
SCHEMBL2450612 0.82 CREBBP (0.41) TNK2SYK
SCHEMBL2444124 0.82 BRD4 (0.35) TNK2SYKCHEK1JAK2ABL1
SCHEMBL2847818 0.82 TNK2 (0.48) TNK2SYKKCNH3ALDH1A1MAPK1
SCHEMBL2443923 0.82 TNK2 (0.48) TNK2SYKKCNH3ALDH1A1MAPK1
SCHEMBL2443934 0.82 TNK2 (0.48) TNK2SYKKCNH3ALDH1A1MAPK1
SCHEMBL2481477 0.79 TNK2 (0.38) HTR2AHTR2CHTR2BTNK2SYK
SCHEMBL2450329 0.78 BRD4 (0.32) TNK2SYK
SCHEMBL2450336 0.78 TNK2 (0.38) TNK2SYKKCNH3ALDH1A1MAPK1
SCHEMBL2450333 0.78 TNK2 (0.38) TNK2SYKKCNH3ALDH1A1MAPK1

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 9 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 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 HTR2A 408/4885HTR2C 963/4885HTR2B 428/4885

“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.