SCHEMBL4742842

SCHEMBL4742842

NC(=O)N=C1C=CC=CC1C=Cc1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.35
LMNA P02545 4/20 0.35
HDAC3 O15379 2/20 0.35
HDAC4 P56524 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC2 Q92769 2/20 0.35
HDAC8 Q9BY41 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35
PLIN1 O60240 2/20 0.35
RECQL P46063 2/20 0.35
PLIN5 Q00G26 2/20 0.35
ABHD5 Q8WTS1 2/20 0.35
TNKS O95271 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35

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
SCHEMBL1966472 0.86 GLA (0.40) MAPTLMNAHDAC3HDAC4HDAC1
SCHEMBL9555439 0.86 MAPT (0.35) MAPTLMNAHDAC3HDAC4HDAC1
SCHEMBL11409353 0.79 ADORA3 (0.45) MAPTLMNAALDH1A1SMN1; SMN2NPC1
SCHEMBL7088421 0.77 KDM1A (0.36) MAPTLMNAALDH1A1CYP1A2CYP2C9
SCHEMBL30052413 0.74 TRPA1 (0.35) MAPTLMNAALDH1A1CYP1A2SMN1; SMN2
SCHEMBL5565774 0.74 KDM1A (0.33) MAPTLMNAKDM1ARAB9ANFKB1
SCHEMBL27919393 0.74 MAPT (0.37) MAPTLMNAHDAC3HDAC4HDAC1
SCHEMBL29962540 0.73 KDM1A (0.42) MAPTLMNAHDAC3HDAC4HDAC1
SCHEMBL30874319 0.73 KDM1A (0.38) MAPTLMNAHDAC3HDAC4HDAC1
SCHEMBL28413151 0.73 KDM1A (0.42) MAPTLMNAHDAC3HDAC4HDAC1

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 MAPT 549/4885LMNA 1915/4885HDAC3 64/4885
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 MAPT 515/4885LMNA 913/4885HDAC3 35/4885

“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.