SCHEMBL5044303

SCHEMBL5044303

CCOc1cc(N)c(C(=O)c2ccccc2)cc1Br

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
POLB P06746 1/20 0.50
LMNA P02545 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HSD17B10 Q99714 2/20 0.49
RAB9A P51151 2/20 0.49
NPC1 O15118 1/20 0.49
USP2 O75604 1/20 0.49
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
HPGD P15428 1/20 0.47
CYP2C19 P33261 1/20 0.47
TSHR P16473 1/20 0.47
PTGDR2 Q9Y5Y4 1/20 0.46
GAA P10253 2/20 0.45
CREBBP Q92793 1/20 0.44
NCOA1 Q15788 1/20 0.44

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
SCHEMBL4709547 0.88 LMNA (0.57) MAPTPOLBLMNASMN1; SMN2HSD17B10
SCHEMBL29022661 0.86 LMNA (0.57) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL6155076 0.85 LMNA (0.51) MAPTMEN1KMT2APOLBLMNA
Methyl Alcohol SCHEMBL28904294 0.84 LMNA (0.50) MAPTMEN1KMT2APOLBLMNA
SCHEMBL5489912 0.83 LMNA (0.52) MAPTKMT2APOLBLMNASMN1; SMN2
SCHEMBL5489041 0.83 LMNA (0.52) MAPTKMT2APOLBLMNASMN1; SMN2
SCHEMBL1580024 0.81 TSHR (0.53) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL1942261 0.81 MAPT (0.54) MAPTMEN1KMT2APOLBLMNA
SCHEMBL28783037 0.80 TSHR (0.47) MEN1KMT2ALMNASMN1; SMN2HSD17B10
SCHEMBL10908517 0.77 POLB (0.52) MAPTPOLBLMNASMN1; SMN2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107311847-B Preparation method of 5-bromo-2-chloro-4' -ethoxy diphenylmethane 安徽省诚联医药科技有限公司 2020-11-10 CN claimed
CN-107311847-B Preparation method of 5-bromo-2-chloro-4' -ethoxy diphenylmethane 安徽省诚联医药科技有限公司 2020-11-10 CN disclosed
CN-107311847-B Preparation method of 5-bromo-2-chloro-4' -ethoxy diphenylmethane 安徽省诚联医药科技有限公司 2020-11-10 CN disclosed
US-7410963-B2 To treat diseases associated with abnormal regulation of intracellular cAMP and/or cGMP rate and abnormal regulation of neurotransmitter effect, with no perturbating effect on memory; autoinflammatory disorders; 3-(8-Methoxy-1-methyl-2-oxo-7-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-5-yl)-benzonitrile VIA PHARMACEUTICALS, INC. (US) 2008-08-12 US disclosed
US-20070123519-A1 Benzo-1,4-diazepin-2-one derivatives as phosphodiesterase pde2 inhibitors, preparation and therapeutic use thereof BAY CITY CAPITAL LLC 2007-05-31 US disclosed
EP-1697332-A1 BENZO'1,4 ! DIAZEPIN-2-ONE DERIVATIVES AS PHOSPHODIESTERASE PDE2 INHIBITORS, PREPARATION AND THERAPEUTIC USE THEREOF NEURO3D (FR) 2006-09-06 EP disclosed
WO-2005063723-A1 BENZO`1,4 ! DIAZEPIN-2-ONE DERIVATIVES AS PHOSPHODIESTERASE PDE2 INHIBITORS, PREPARATION AND THERAPEUTIC USE THEREOF NEURO3D (FR) 2005-07-14 WO disclosed
EP-1548011-A1 Benzo[1,4]diazepin-2-one derivatives as phosphodiesterase PDE2 inhibitors, preparation and therapeutic use thereof NEURO3D (FR) 2005-06-29 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 (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-20070123519-A1 Benzo-1,4-diazepin-2-one derivatives as phosphodiesterase pde2 inhibitors, preparation and therapeutic use thereof PDE12, PDE2A, PDE3A MAPT 2783/4885MEN1 2240/4885KMT2A 1615/4885

“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.