SCHEMBL715587

SCHEMBL715587

CNc1c(Cl)ccc2nc(-n3ccnc3)nc(-c3ccccc3)c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.47
LMNA P02545 2/20 0.47
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
PDE5A O76074 11/20 0.43
TSHR P16473 6/20 0.43
NPC1 O15118 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TBXAS1 P24557 3/20 0.41
PDE3B Q13370 3/20 0.41
PDE3A Q14432 3/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
POLB P06746 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2D6 P10635 2/20 0.40

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
SCHEMBL5598644 0.78 NAMPT (0.35)
SCHEMBL432878 0.74 CYP3A4 (0.52) NPSR1LMNAMEN1USP2KMT2A
SCHEMBL27428610 0.68 NPSR1 (0.59) NPSR1LMNAMEN1USP2KMT2A
SCHEMBL4381915 0.67 PDE5A (0.69) PDE5ATBXAS1PDE3BPDE3APTGS1
SCHEMBL19764716 0.66 LMNA (0.93) NPSR1LMNAMEN1USP2KMT2A
SCHEMBL20957843 0.65 NPSR1 (0.54) NPSR1LMNAMEN1USP2KMT2A
SCHEMBL8302217 0.63 PDE5A (0.59) NPSR1LMNAMEN1USP2KMT2A
SCHEMBL8544658 0.62 PDE5A (0.41) NPSR1LMNAMEN1USP2KMT2A
SCHEMBL15289603 0.61 LMNA (0.60) NPSR1LMNAMEN1USP2KMT2A
SCHEMBL715585 0.61 PDE5A (1.00) PDE5ATBXAS1PDE3BPDE3APTGS1

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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090041675-A1 Organic compounds TRIFILIEFF ALEXANDRE 2009-02-12 US claimed
EP-1140044-B1 cGMP PDE 5 INHIBITORS FOR INHALATION IN THE TREATMENT OF SEXUAL DYSFUNCTION NOVARTIS AG (CH) 2006-03-15 EP claimed
US-10994082-B2 Inhaler counter ASTRAZENECA AB (SE) 2021-05-04 US disclosed
US-20190175849-A1 INHALER COUNTER BANG & OLUFSEN MEDICOM A/S (DK) 2019-06-13 US disclosed
US-20180339119-A1 INHALER BANG & OLUFSEN MEDICOM A/S (DK) 2018-11-29 US disclosed
EP-2755707-B1 INHALER ASTRAZENECA AB (SE) 2018-11-14 EP disclosed
EP-3345644-A1 INHALER Astrazeneca AB (SE) 2018-07-11 EP disclosed
EP-2755708-B1 INHALER ASTRAZENECA AB (SE) 2018-05-09 EP disclosed
EP-2448623-B1 DISPENSER AND METHOD FOR ENTRAINING POWDER IN AN AIRFLOW ASTRAZENECA AB (SE) 2017-12-20 EP disclosed
EP-2341968-B1 A BREATH ACTIVATED INHALER ASTRAZENECA AB (SE) 2017-05-10 EP disclosed
US-9289565-B2 Inhaler with indexing linked to movement of cover ASTRAZENECA AB (SE) 2016-03-22 US disclosed
CN-101652137-A Combinations of beta- 2 -adrenoceptor agonistic benzothiazolone ASTRAZENECA AB SE 2010-02-17 CN disclosed
US-20100029732-A1 Combinations of Beta-2-Adrenoceptor Agonistic Benzothiazolone ASTRAZENECA AB (SE) 2010-02-04 US disclosed
EP-2117542-A1 COMBINATIONS OF BETA- 2 -ADRENOCEPTOR AGONISTIC BENZOTHIAZOLONE AstraZeneca AB (SE) 2009-11-18 EP disclosed
WO-2009037503-A2 NEW COMBINATION - 012 FOR THE TREATMENT OF RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2009-03-26 WO disclosed
US-20090041675-A1 Organic compounds TRIFILIEFF ALEXANDRE 2009-02-12 US disclosed
US-20080242649-A1 New Combination 665 ASTRAZENECA AB (SE) 2008-10-02 US disclosed
WO-2008104776-A1 COMBINATIONS OF BETA-2-ADRENOCEPTOR AGONISTIC BENZOTHIAZOLONE ASTRAZENECA AB (SE) 2008-09-04 WO disclosed
WO-2008096111-A1 COMBINATIONS OF BETA- 2 -ADRENOCEPTOR AGONISTIC BENZOTHIAZOLONE ASTRAZENECA AB (SE) 2008-08-14 WO disclosed
WO-2008096121-A1 COMBINATIONS OF BETA-2-ADRENOCEPTOR AGONISTIC BENZOTHIAZOLONE ASTRAZENECA AB (SE) 2008-08-14 WO 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 (3 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-20090041675-A1 Organic compounds PDE12, PDE5A, RXFP4 NPSR1 473/4885LMNA 4127/4885MEN1 4412/4885
US-20080242649-A1 New Combination 665 NR3C2, PTGER2, GRK5 NPSR1 1658/4885LMNA 3129/4885MEN1 4750/4885
US-20100029732-A1 Combinations of Beta-2-Adrenoceptor Agonistic Benzothiazolone NR3C2, NR3C1, ARRB1 NPSR1 1128/4885LMNA 3077/4885MEN1 4742/4885

“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.