SCHEMBL2447040

SCHEMBL2447040

Cc1nccn1-c1ccc(Nc2nc3c(c(CCc4cccc(F)c4)n2)CNCC3)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 3/20 0.37
P2RX4 Q99571 2/20 0.37
STAT6 P42226 2/20 0.37
HTR2C P28335 3/20 0.36
HTR2B P41595 1/20 0.36
AXL P30530 1/20 0.36
TYRO3 Q06418 1/20 0.36
MERTK Q12866 1/20 0.36
HTR2A P28223 2/20 0.36
HTR1A P08908 1/20 0.36
DRD2 P14416 1/20 0.36
HTR7 P34969 1/20 0.36
DRD3 P35462 1/20 0.36
HTR6 P50406 1/20 0.36
NR3C2 P08235 1/20 0.35
KDR P35968 1/20 0.35
PTK2 Q05397 2/20 0.35
EGFR P00533 1/20 0.35
ROCK2 O75116 1/20 0.35
BRD4 O60885 1/20 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
SCHEMBL2451552 0.87 ROCK2 (0.43) NTRK1P2RX4STAT6NR3C2KDR
SCHEMBL2480963 0.85 HTR2C (0.39) HTR2CHTR2BHTR2AHTR1ADRD2
SCHEMBL2480448 0.84 ROCK2 (0.39) NTRK1P2RX4STAT6NR3C2KDR
SCHEMBL2444206 0.84 CREBBP (0.40) NTRK1KDRPTK2ROCK2BRD4
SCHEMBL2479140 0.84 ROCK2 (0.38) NTRK1P2RX4STAT6AXLTYRO3
SCHEMBL2446003 0.83 HTR2A (0.40) STAT6HTR2CAXLTYRO3MERTK
SCHEMBL2482883 0.83 HTR2C (0.36) STAT6HTR2CHTR2BAXLTYRO3
SCHEMBL2482372 0.82 TUBB4A (0.37) STAT6HTR2CHTR2BHTR2AHTR1A
SCHEMBL2449795 0.81 SYK (0.37) KDRBRD4
SCHEMBL2484835 0.81 SYK (0.37) HTR2CHTR2AKDREGFRROCK2

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 NTRK1 2626/4885P2RX4 3231/4885STAT6 3493/4885

“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.