SCHEMBL227362

SCHEMBL227362

CC(C)(O)c1ccccc1[C@H](CCSCC1(CC(=O)O)CC1)c1cccc(C=Cc2ccc3sc(Cl)c(Cl)c3n2)c1

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 20/20 0.75
CYSLTR1 Q9Y271 20/20 0.75

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
SCHEMBL209124 1.00 CYSLTR2 (0.75) CYSLTR2CYSLTR1
SCHEMBL5971548 1.00 CYSLTR2 (0.75) CYSLTR2CYSLTR1
SCHEMBL589317 1.00 CYSLTR2 (0.75) CYSLTR2CYSLTR1
SCHEMBL3263816 0.94 CYSLTR2 (0.69) CYSLTR2CYSLTR1
SCHEMBL3263812 0.94 CYSLTR2 (0.69) CYSLTR2CYSLTR1
SCHEMBL2125181 0.94 CYSLTR2 (0.67) CYSLTR2CYSLTR1
SCHEMBL2125184 0.94 CYSLTR2 (0.67) CYSLTR2CYSLTR1
SCHEMBL2124624 0.93 CYSLTR2 (0.66) CYSLTR2CYSLTR1
SCHEMBL5601096 0.89 CYSLTR1 (0.66) CYSLTR2CYSLTR1
SCHEMBL5200473 0.85 CYSLTR2 (1.00) CYSLTR2CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070037781-A1 Novel combinations of medicaments for the treatment of respiratory diseases containing long-acting beta-agonists and at least one additional active ingredient BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-02-15 US claimed
US-20230372297-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES BOEHRINGER INGELHEIM INT (DE) 2023-11-23 US disclosed
US-11046706-B2 CCR2 receptor antagonists and uses thereof CENTREXION THERAPEUTICS CORPORATION (US) 2021-06-29 US disclosed
US-20200330435-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES BOEHRINGER INGELHEIM INT (DE) 2020-10-22 US disclosed
EP-3643309-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES Boehringer Ingelheim International GmbH (DE) 2020-04-29 EP disclosed
EP-2878297-B1 Medicaments for the treatment or prevention of fibrotic diseases BOEHRINGER INGELHEIM INT (DE) 2020-03-25 EP disclosed
EP-2326374-B1 INHALER BOEHRINGER INGELHEIM INT (DE) 2020-03-04 EP disclosed
US-20190300541-A1 CCR2 RECEPTOR ANTAGONISTS AND USES THEREOF ANKURA TRUST COMPANY, LLC, AS ADMINISTRATIVE AND COLLATERAL AGENT 2019-10-03 US disclosed
US-10220165-B2 Inhalator and capsule for an inhalator BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2019-03-05 US disclosed
US-20190038600-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DEISEASES BOEHRINGER INGELHEIM INT (DE) 2019-02-07 US disclosed
US-6716846-B2 CONTROLLING PAIN IN MAMMALS SCHERING CORPORATION 2004-04-06 US disclosed
US-20030195185-A1 Azetidinyl diamines useful as ligands of the nociceptin receptor ORL-1 SCHERING CORPORATION 2003-10-16 US disclosed
US-20030119847-A1 Heteroaryl derivatives as superior ligands for nociceptin receptor ORL-1 SCHERING CORPORATION 2003-06-26 US disclosed
WO-2003043980-A1 AZETIDINYL DIAMINES USEFUL AS LIGANDS OF THE NOCICEPTIN RECEPTOR ORL-1 SCHERING CORPORATION (US) 2003-05-30 WO disclosed
WO-2003039469-A2 HETEROARYL DERIVATIVES AS SUPERIOR LIGANDS FOR NOCICEPTIN RECEPTOR ORL-1 SCHERING CORPORATION (US) 2003-05-15 WO disclosed
US-20030073690-A1 High affinity ligands for nociceptin receptor ORL-1 MERCK SHARP & DOHME CORP. 2003-04-17 US disclosed
WO-2002067938-A2 TREATING OR REDUCING THE RISK OF CARDIOVASCULAR DISEASE SCHERING CORPORATION (US) 2002-09-06 WO disclosed
US-20020061902-A1 Treatment method SCHERING CORPORATION 2002-05-23 US disclosed
US-20010011092-A1 High affinity ligands for nociceptin receptor ORL-1 MERCK SHARP & DOHME CORP. 2001-08-02 US disclosed
US-6262066-B1 High affinity ligands for nociceptin receptor ORL-1 SCHERING CORPORATION 2001-07-17 US 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 (10 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-20190300541-A1 CCR2 RECEPTOR ANTAGONISTS AND USES THEREOF CCR2, CCRL2, CCR1 CYSLTR2 19/4885CYSLTR1 23/4885
US-11046706-B2 CCR2 receptor antagonists and uses thereof CCR2, CCRL2, CCR1 CYSLTR2 19/4885CYSLTR1 23/4885
US-20070037781-A1 Novel combinations of medicaments for the treatment of respiratory diseases containing long-acting beta-agonists and at least one additional active ingredient ADRB2, ADRA2A, ADRB1 CYSLTR2 157/4885CYSLTR1 216/4885
US-20200330435-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES MMP1, COL1A1, FOXM1 CYSLTR2 242/4885CYSLTR1 101/4885
US-20030073690-A1 High affinity ligands for nociceptin receptor ORL-1 OPRL1, OGFRL1, OPRD1 CYSLTR2 54/4885CYSLTR1 26/4885
US-20230372297-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES MMP1, COL1A1, SMAD3 CYSLTR2 221/4885CYSLTR1 142/4885
US-20030195185-A1 Azetidinyl diamines useful as ligands of the nociceptin receptor ORL-1 OPRL1, OPRD1, OPRM1 CYSLTR2 151/4885CYSLTR1 45/4885
US-20030119847-A1 Heteroaryl derivatives as superior ligands for nociceptin receptor ORL-1 OPRL1, OPRD1, OPRK1 CYSLTR2 152/4885CYSLTR1 63/4885
US-20010011092-A1 High affinity ligands for nociceptin receptor ORL-1 OPRL1, OGFRL1, OPRD1 CYSLTR2 54/4885CYSLTR1 26/4885
US-20190038600-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DEISEASES MMP1, COL1A1, IDO1 CYSLTR2 1218/4885CYSLTR1 504/4885

“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.