SCHEMBL2164341

SCHEMBL2164341

N#Cc1c(F)cccc1OCC1CCC(Cc2ccccc2F)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.44
CYP2D6 P10635 1/20 0.41
DCPS Q96C86 1/20 0.41
KDM4E B2RXH2 1/20 0.39
HTR1A P08908 2/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
KCNN4 O15554 1/20 0.38
CCR3 P51677 1/20 0.37
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
ATM Q13315 1/20 0.36
POLB P06746 1/20 0.36
HTR2C P28335 2/20 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
SCHEMBL2164306 0.90 HSD11B1 (0.41) RIPK1CYP2D6DCPSKDM4EHTR1A
SCHEMBL2165609 0.90 RIPK1 (0.43) RIPK1CYP2D6DCPSKDM4EHTR1A
SCHEMBL1154384 0.89 KDM4E (0.46) RIPK1DCPSKDM4EKCNN4HTR2C
SCHEMBL12404096 0.87 TSHR (0.41) RIPK1KDM4EHTR1AKCNN4SLC6A2
SCHEMBL30175284 0.84 MCHR1 (0.45) KDM4EKCNN4HTR2C
SCHEMBL1154431 0.84 MCHR1 (0.45) KDM4EKCNN4HTR2C
SCHEMBL1154568 0.84 MCHR1 (0.45) RIPK1KDM4EKCNN4HTR2C
SCHEMBL1154425 0.82 MCHR1 (0.46) KDM4EKCNN4
SCHEMBL2164263 0.80 KDM4E (0.39) KDM4ESLC6A4MAPTHTTATM
SCHEMBL2164256 0.80 SLC6A2 (0.43) KDM4EHTR1ASLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2069316-B1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2015-10-07 EP disclosed
EP-2615086-A1 2,4-Diaminoquinazolines for the treatment of spinal muscular atrophy Families of Spinal Muscular Atrophy (US) 2013-07-17 EP disclosed
US-7985755-B2 2,4-diaminoquinazolines for spinal muscular atrophy FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2011-07-26 US disclosed
EP-2069316-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY Families of Spinal Muscular Atrophy (US) 2009-06-17 EP disclosed
US-20090042900-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY DECODE CHEMISTRY, INC. (US) 2009-02-12 US disclosed
WO-2008016973-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY FAMILIES OF SPINAL MUSCULAR ATROPHY (US) 2008-02-07 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-20090042900-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY SMN1; SMN2, MUSK, MYT1 RIPK1 3668/4885CYP2D6 3869/4885DCPS 1366/4885

“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.