SCHEMBL1084196

SCHEMBL1084196

CCN(CC)c1nc(-c2ccccc2F)nc2ccc(Cl)cc12

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
MAPT P10636 4/20 0.59
ACP1 P24666 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GAA P10253 1/20 0.46
HIF1A Q16665 1/20 0.46
GBA1 P04062 1/20 0.45
TP53 P04637 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
DPP4 P27487 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.40
FABP4 P15090 2/20 0.39
FABP5 Q01469 2/20 0.39
APEX1 P27695 1/20 0.39

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
SCHEMBL1084090 0.90 LMNA (0.61) LMNAMAPTACP1L3MBTL1SMN1; SMN2
SCHEMBL1084384 0.89 MAPT (0.52) LMNAMAPTL3MBTL1SMN1; SMN2GBA1
SCHEMBL1084188 0.86 CYP1A2 (0.50) LMNAMAPTSMN1; SMN2HIF1AGBA1
SCHEMBL1083944 0.84 LMNA (0.81) LMNAMAPTACP1L3MBTL1SMN1; SMN2
SCHEMBL13342370 0.82 GBA1 (0.55) LMNAMAPTL3MBTL1SMN1; SMN2GBA1
SCHEMBL1084301 0.81 MAPT (0.49) LMNAMAPTSMN1; SMN2GBA1DPP4
SCHEMBL13984347 0.79 LMNA (0.55) LMNAMAPTSMN1; SMN2HIF1AGBA1
SCHEMBL1084031 0.76 CYP1A2 (0.50) LMNAMAPTSMN1; SMN2HIF1AGBA1
SCHEMBL8381530 0.76 ACP1 (0.42) ACP1L3MBTL1GAAPOLBMAPK1
SCHEMBL1084483 0.76 MAPT (0.51) LMNAMAPTACP1L3MBTL1SMN1; SMN2

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-8343980-B2 Quinazoles useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-01-01 US disclosed
US-8343980-B2 Quinazoles useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-01-01 US disclosed
US-8153642-B2 Quinazolines useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-04-10 US disclosed
US-8153642-B2 Quinazolines useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-04-10 US disclosed
US-20100160316-A1 QUINAZOLINES USEFUL AS MODULATORS OF ION CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-06-24 US disclosed
US-20100160316-A1 QUINAZOLINES USEFUL AS MODULATORS OF ION CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-06-24 US disclosed
US-7713983-B2 Quinazolines useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-05-11 US disclosed
US-7713983-B2 Quinazolines useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-05-11 US disclosed
US-7678802-B2 Quinazolines useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-03-16 US disclosed
US-7678802-B2 Quinazolines useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-03-16 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 (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-20100160316-A1 QUINAZOLINES USEFUL AS MODULATORS OF ION CHANNELS KCNN3, KCNN2, CACNA1I LMNA 2188/4885MAPT 1868/4885ACP1 4214/4885

“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.