SCHEMBL4742835

SCHEMBL4742835

NC(=O)N1C(c2ccccc2)=C1c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
TSHR P16473 2/20 0.47
MAPK1 P28482 1/20 0.47
SCN4A P35499 1/20 0.47
SCN5A Q14524 1/20 0.47
SCN9A Q15858 1/20 0.47
BCHE P06276 1/20 0.45
ACHE P22303 1/20 0.45
BCAT2 O15382 2/20 0.43
MAPT P10636 3/20 0.42
PARP1 P09874 2/20 0.42
POLB P06746 2/20 0.42
CYP3A4 P08684 2/20 0.42
BLM P54132 2/20 0.42
CYP2C19 P33261 1/20 0.42
RECQL P46063 1/20 0.42
PMP22 Q01453 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL1966470 0.76 SMN1; SMN2 (0.46) LMNAMAPTPOLBHSD17B10NQO2
SCHEMBL7519169 0.76 P2RX4 (0.45) LMNATSHRMAPTPOLBGAA
Biphenyl SCHEMBL11184429 0.74 ALDH1A1 (0.53) LMNATSHRBCAT2MAPTPARP1
Biphenyl SCHEMBL6469097 0.74 ALDH1A1 (0.53) LMNATSHRBCAT2MAPTPARP1
Biphenyl SCHEMBL473288 0.73 ALDH1A1 (0.60) LMNATSHRBCAT2MAPTPARP1
Biphenyl SCHEMBL4593266 0.73 ALDH1A1 (0.60) LMNATSHRBCAT2MAPTPARP1
Biphenyl SCHEMBL335359 0.73 ALDH1A1 (0.60) LMNATSHRBCAT2MAPTPARP1
Biphenyl SCHEMBL1952613 0.73 ALDH1A1 (0.60) LMNATSHRBCAT2MAPTPARP1
SCHEMBL3296716 0.72 TSHR (0.71) LMNATSHRMAPK1SCN4ASCN5A
Biphenyl SCHEMBL4912411 0.72 LMNA (0.50) LMNATSHRBCAT2MAPTPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1748988-A1 A PROCESS FOR THE PREPARATION OF IMINOSTILBENE DERIVATIVES Milanese, Alberto (IT) 2007-02-07 EP claimed
WO-2005118550-A1 A PROCESS FOR THE PREPARATION OF IMINOSTILBENE DERIVATIVES MILANESE ALBERTO (IT) 2005-12-15 WO claimed
WO-2008108639-A1 CO-CRYSTALLINE FORMS OF CARBAMAZEPINE AVANTIUM HOLDING B.V. (NL) 2008-09-12 WO disclosed
US-20060094709-A1 Methods for the treatment of bipolar disorder using carbamazepine VALIDUS PHARMACEUTICALS LLC 2006-05-04 US disclosed
US-6977253-B2 Methods for the treatment of bipolar disorder using carbamazepine SHIRE PHARMACEUTICAL DEVELOPMENT INC. (US) 2005-12-20 US disclosed
US-20050124601-A1 in extended release form; initial daily dose is increased in daily increments; can be co-administered with lithium carbonate, sodium valproate, chlorpromazine, olanzapine, lamotrigine, and/or gabapentin VALIDUS PHARMACEUTICALS LLC 2005-06-09 US disclosed
EP-1026158-B1 Process for the preparation of 5-carbamoyl-5H-dibenz(b,f)azepine MAX INDIA LTD (IN) 2003-09-24 EP disclosed
US-6245908-B1 Process for preparing carbamazepine from iminostilbene MAX INDIA LIMITED (IN) 2001-06-12 US disclosed
EP-1026158-A1 Process for the preparation of 5-carbamoyl-5H-dibenz(b,f)azepine Max India Limited (IN) 2000-08-09 EP 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-20060094709-A1 Methods for the treatment of bipolar disorder using carbamazepine GABBR2, GABRE, GABBR1 LMNA 1915/4885TSHR 3689/4885MAPK1 4874/4885
US-20050124601-A1 in extended release form; initial daily dose is increased in daily increments; can be co-administered with lithium carbonate, sodium valproate, chlorpromazine, olanzapine, lamotrigine, and/or gabapentin SLC6A1, SLC6A11, GABRE LMNA 913/4885TSHR 820/4885MAPK1 4713/4885

“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.