SCHEMBL1084384

SCHEMBL1084384

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.52
GBA1 P04062 1/20 0.52
LMNA P02545 6/20 0.51
FABP4 P15090 2/20 0.50
FABP5 Q01469 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.46
CYP1A2 P05177 3/20 0.45
MAT2A P31153 2/20 0.45
PRMT5 O14744 1/20 0.45
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C19 P33261 1/20 0.41
CSF1R P07333 1/20 0.41
DPP4 P27487 1/20 0.40
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 1/20 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
SCHEMBL1084196 0.89 LMNA (0.61) MAPTGBA1LMNAFABP4FABP5
SCHEMBL13342370 0.88 GBA1 (0.55) MAPTGBA1LMNAFABP4FABP5
SCHEMBL1084188 0.88 CYP1A2 (0.50) MAPTGBA1LMNASMN1; SMN2CYP1A2
SCHEMBL1083941 0.85 MAPT (0.70) MAPTGBA1LMNASMN1; SMN2CYP1A2
SCHEMBL1084301 0.83 MAPT (0.49) MAPTGBA1LMNASMN1; SMN2CYP1A2
SCHEMBL13342371 0.81 GBA1 (0.48) MAPTGBA1LMNAFABP4FABP5
SCHEMBL1084027 0.81 PDE5A (0.53) MAPTGBA1LMNASMN1; SMN2CYP1A2
SCHEMBL1084090 0.80 LMNA (0.61) MAPTGBA1LMNAFABP4FABP5
SCHEMBL1084149 0.79 GBA1 (0.55) MAPTGBA1LMNASMN1; SMN2CYP1A2
SCHEMBL13984347 0.78 LMNA (0.55) MAPTGBA1LMNAFABP4SMN1; 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 MAPT 1868/4885GBA1 760/4885LMNA 2188/4885

“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.