SCHEMBL435661

SCHEMBL435661

Cc1cc(Cl)ccc1NC(=O)N1CCC(CNS(=O)(=O)c2ccc(C(C)C)cc2)(c2ccccc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
OPRM1 P35372 1/20 0.40
OPRL1 P41146 1/20 0.40
MAPK8 P45983 1/20 0.40
MAPK10 P53779 1/20 0.40
FAAH O00519 1/20 0.39
APP P05067 1/20 0.39
CCR8 P51685 2/20 0.39
PANK3 Q9H999 1/20 0.38
KCNH2 Q12809 1/20 0.38
CACNA1I Q9P0X4 1/20 0.38
MAPT P10636 2/20 0.38
EPHX2 P34913 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
TP53 P04637 1/20 0.38
TACR1 P25103 1/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MCHR1 Q99705 1/20 0.37

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
SCHEMBL2838092 0.83 OPRM1 (0.44) OPRM1OPRL1MAPTLMNAPOLB
SCHEMBL2190767 0.80 TP53 (0.42) KMT2AOPRM1OPRL1MAPTLMNA
SCHEMBL9141149 0.69 OPRM1 (0.60) KMT2AOPRM1OPRL1MAPTLMNA
SCHEMBL9139656 0.69 OPRM1 (0.60) KMT2AOPRM1OPRL1MAPTLMNA
SCHEMBL9818687 0.68 TP53 (0.60) KMT2AKCNH2CACNA1IMAPTLMNA
SCHEMBL14372216 0.66 MEN1 (0.57) KMT2AMAPTLMNAPOLBTP53
SCHEMBL701894 0.65 TAS1R3 (0.75) KMT2AMAPTTP53MEN1
SCHEMBL4673514 0.65 RAB9A (0.55) KMT2AMAPK8MAPK10MAPTPOLB
SCHEMBL11984935 0.63 CCR1 (0.51) KMT2AOPRM1KCNH2MAPTLMNA
SCHEMBL14278986 0.63 CCR1 (0.52) KMT2AOPRM1OPRL1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-2334358-B1 INHALATION DEVICE FOR DISPENSING MEDICAMENT ASTRAZENECA AB (SE) 2016-02-10 EP disclosed
US-9211383-B2 Dispenser and method for entraining powder in an airflow ASTRAZENECA AB (SE) 2015-12-15 US disclosed
US-9155851-B2 Breath activated inhaler ASTRAZENECA AB (SE) 2015-10-13 US disclosed
WO-2010042036-A1 INHALER WITH AUDIBLE INDICATOR MEANS ASTRAZENECA AB (SE) 2010-04-15 WO disclosed
WO-2010042034-A1 A BREATH ACTIVATED INHALER ASTRAZENECA AB (SE) 2010-04-15 WO disclosed
US-20100051027-A1 Entraining Powder In An Airflow ASTRAZENECA AB (SE) 2010-03-04 US disclosed
US-20100029732-A1 Combinations of Beta-2-Adrenoceptor Agonistic Benzothiazolone ASTRAZENECA AB (SE) 2010-02-04 US disclosed
WO-2010004319-A1 COMBINATION COMPRISING 6-FLU0R0-N- ((1S, 4S) - 4- (6-FLUORO-2, 4-DI0X0-1- (4'- (PIPERAZIN-1- YLMETHYL) BIPHENYL- 3-YL) -1, 2-DIHYDROPYRIDO [2, 3-D] PYRIMIDIN-3 (4H) - YL) CYCLOHEXYL) IMIDAZO [1,2-A] PYRIDINE -2- CARBOXAMIDE OR A SALT ASTRAZENECA AB (SE) 2010-01-14 WO disclosed
WO-2009154562-A1 PHARMACEUTICAL COMPOSITION COMPRISING A 4-HYDROXY-2-OXO-2, 3- DIHYDRO-1, 3-BENZOTHIAZOL-7-YL COMPOUND FOR MODULATION OF BETA2-ADRENORECEPTOR ACTIVITY ASTRAZENECA AB (SE) 2009-12-23 WO disclosed
WO-2009037503-A2 NEW COMBINATION - 012 FOR THE TREATMENT OF RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2009-03-26 WO 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-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 (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-20080242649-A1 New Combination 665 NR3C2, PTGER2, GRK5 KMT2A 2257/4885OPRM1 856/4885OPRL1 190/4885
US-20100029732-A1 Combinations of Beta-2-Adrenoceptor Agonistic Benzothiazolone NR3C2, NR3C1, ARRB1 KMT2A 2406/4885OPRM1 851/4885OPRL1 169/4885

“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.