SCHEMBL87115

SCHEMBL87115

Cc1cccc2c1N=C(/C=C(\O)c1ccc3[nH]cnc3c1)N1CCN=C21

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HDAC8 Q9BY41 1/20 0.34
PIK3CB P42338 1/20 0.32
PIK3CG P48736 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
PTAFR P25105 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL12533386 0.89 TDP1 (0.31) LMNASMN1; SMN2HDAC8L3MBTL1
SCHEMBL14041146 0.89 LMNA (0.35) LMNASMN1; SMN2HDAC8L3MBTL1CTDSP1
SCHEMBL86614 0.86 MEN1 (0.32) LMNASMN1; SMN2L3MBTL1MEN1KMT2A
SCHEMBL86847 0.85 PIK3CB (0.35) SMN1; SMN2HDAC8PIK3CBPIK3CGL3MBTL1
SCHEMBL86628 0.84 TDP1 (0.30) L3MBTL1
SCHEMBL86849 0.83 PIK3CB (0.32) PIK3CBPIK3CG
SCHEMBL86697 0.81 L3MBTL1 (0.35) L3MBTL1PTAFRMEN1KMT2A
SCHEMBL86826 0.81 NPC1 (0.40) LMNASMN1; SMN2L3MBTL1CTDSP1MEN1
SCHEMBL81629 0.79 KMT2A (0.37) HDAC8L3MBTL1PTAFRMEN1KMT2A
SCHEMBL81628 0.79 KMT2A (0.37) HDAC8L3MBTL1PTAFRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130184270-A1 SUBSTITUTED 2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLINE-CONTAINING COMBINATIONS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-07-18 US disclosed
US-20130184270-A1 SUBSTITUTED 2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLINE-CONTAINING COMBINATIONS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-07-18 US disclosed
US-8129386-B2 Fused azole-pyrimidine derivatives BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-03-06 US disclosed
US-8129386-B2 Fused azole-pyrimidine derivatives BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-03-06 US disclosed
EP-2042504-B1 Fused azole-pyrimidine derivatives BAYER SCHERING PHARMA AG (DE) 2011-06-01 EP disclosed
US-20090270388-A1 FUSED AZOLE-PYRIMIDINE DERIVATIVES BAYER PHARMACEUTICALS CORPORATION (US) 2009-10-29 US disclosed
US-20090270388-A1 FUSED AZOLE-PYRIMIDINE DERIVATIVES BAYER PHARMACEUTICALS CORPORATION (US) 2009-10-29 US disclosed
EP-2042504-A1 Fused azole-pyrimidine derivatives Bayer HealthCare AG (DE) 2009-04-01 EP disclosed
US-7511041-B2 Fused azole-pyrimidine derivatives BAYER PHARMACEUTICALS CORPORATION (US) 2009-03-31 US disclosed
US-7511041-B2 Fused azole-pyrimidine derivatives BAYER PHARMACEUTICALS CORPORATION (US) 2009-03-31 US 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 (2 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-20090270388-A1 FUSED AZOLE-PYRIMIDINE DERIVATIVES PIK3CA, PIK3CD, PIK3R5 LMNA 4764/4885SMN1; SMN2 3659/4885HDAC8 2721/4885
US-20130184270-A1 SUBSTITUTED 2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLINE-CONTAINING COMBINATIONS KIT, CSNK2A1, CSNK1A1 LMNA 1290/4885SMN1; SMN2 1755/4885HDAC8 1788/4885

“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.