SCHEMBL2168162

SCHEMBL2168162

Nc1nc(N)c2c(N3CCN(C(=O)c4ccc5ccccc5c4)CC3)cccc2n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.54
TSHR P16473 2/20 0.54
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
POLB P06746 1/20 0.52
ALDH1A1 P00352 5/20 0.51
HTT P42858 3/20 0.51
GAA P10253 3/20 0.51
NPSR1 Q6W5P4 2/20 0.51
HSD17B10 Q99714 2/20 0.51
MAPT P10636 2/20 0.51
USP2 O75604 1/20 0.51
ALOX15 P16050 1/20 0.51
HPGD P15428 1/20 0.50
AKR1C1 Q04828 1/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48

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
SCHEMBL2166325 0.88 KDM4E (0.52) TSHRMEN1KMT2APOLBALDH1A1
SCHEMBL2165448 0.86 HPGD (0.47) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL2168221 0.85 HPGD (0.51) LMNATSHRMEN1KMT2APOLB
SCHEMBL2166122 0.85 MEN1 (0.52) LMNATSHRMEN1KMT2APOLB
SCHEMBL2166066 0.85 ALDH1A1 (0.51) LMNATSHRMEN1KMT2AALDH1A1
SCHEMBL2164157 0.85 L3MBTL1 (0.50) LMNATSHRMEN1KMT2AALDH1A1
SCHEMBL2166078 0.85 ALDH1A1 (0.58) LMNATSHRKMT2APOLBALDH1A1
SCHEMBL2166596 0.82 USP2 (0.60) LMNATSHRMEN1KMT2APOLB
SCHEMBL2166586 0.80 SMN1; SMN2 (0.55) LMNATSHRMEN1KMT2APOLB
SCHEMBL2166042 0.80 RAB9A (0.53) MEN1KMT2APOLBALDH1A1GAA

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 LMNA 422/4885TSHR 4604/4885MEN1 2425/4885

“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.