SCHEMBL543334

SCHEMBL543334

NC1CCC(CNc2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.50
PRMT6 Q96LA8 1/20 0.50
CRHR1 P34998 2/20 0.45
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KCNH3 Q9ULD8 1/20 0.42
ACHE P22303 1/20 0.41
BACE1 P56817 1/20 0.41
PRKCQ Q04759 2/20 0.41
GBA1 P04062 1/20 0.41
EPHX1 P07099 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
TLR7 Q9NYK1 1/20 0.38
APP P05067 1/20 0.38
KDM1A O60341 2/20 0.38
MAOB P27338 2/20 0.38
MAOA P21397 1/20 0.38

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
SCHEMBL1846502 1.00 CARM1 (0.50) CARM1PRMT6CRHR1NPC1RAB9A
SCHEMBL13438662 0.93 CARM1 (0.46) CARM1PRMT6CRHR1NPC1RAB9A
SCHEMBL11934776 0.93 CARM1 (0.46) CARM1PRMT6CRHR1NPC1RAB9A
SCHEMBL10055002 0.90 CARM1 (0.57) CARM1PRMT6CRHR1NPC1RAB9A
SCHEMBL1722281 0.90 CARM1 (0.57) CARM1PRMT6CRHR1NPC1RAB9A
SCHEMBL10055063 0.90 CARM1 (0.57) CARM1PRMT6CRHR1NPC1RAB9A
SCHEMBL18434523 0.90 CARM1 (0.57) CARM1PRMT6CRHR1NPC1RAB9A
SCHEMBL11935284 0.90 SMYD3 (0.44) CARM1PRMT6CRHR1ACHEBACE1
SCHEMBL13438690 0.90 SMYD3 (0.44) CARM1PRMT6CRHR1ACHEBACE1
SCHEMBL13438985 0.90 SMYD3 (0.44) CARM1PRMT6CRHR1ACHEBACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140088105-A1 Cyclohexyl Amide Derivatives and Their Use as CRF-1 Receptor Antagonists NOVARTIS AG (CH) 2014-03-27 US claimed
JP-2011529944-A 2011-12-15 JP claimed
WO-2010015655-A1 CYCLOHEXYL AMIDE DERIVATIVES AND THEIR USE AS CRF-1 RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2010-02-11 WO claimed
US-20100035898-A1 Organic compounds NOVARTIS AG (CH) 2010-02-11 US claimed
EP-3464274-B1 BENZAZEPINE DICARBOXAMIDE COMPOUNDS WITH SECONDARY AMIDE FUNCTION HOFFMANN LA ROCHE (CH) 2020-05-27 EP disclosed
US-10544102-B2 Benzazepine dicarboxamide compounds with secondary amide function HOFFMANN-LA ROCHE INC. (US) 2020-01-28 US disclosed
US-20190077764-A1 BENZAZEPINE DICARBOXAMIDE COMPOUNDS WITH SECONDARY AMIDE FUNCTION HOFFMANN-LA ROCHE INC. (US) 2019-03-14 US disclosed
EP-2323970-B1 CYCLOHEXYL AMIDE DERIVATIVES AND THEIR USE AS CRF-1 RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2016-04-20 EP disclosed
US-8759455-B2 Two-stage curable composition containing a surface-deactivated polyisocyanate SIKA TECHNOLOGY AG (CH) 2014-06-24 US disclosed
CN-102143940-B Cyclohexyl amide derivatives as CRF-1 receptor antagonists and uses thereof NOVARTIS AG 2014-04-16 CN disclosed
US-20140088105-A1 Cyclohexyl Amide Derivatives and Their Use as CRF-1 Receptor Antagonists NOVARTIS AG (CH) 2014-03-27 US disclosed
US-8614213-B2 Cyclohexyl amide derivatives and their use as CRF-1 receptor antagonists NOVARTIS AG (CH) 2013-12-24 US disclosed
CN-102143940-A Cyclohexyl amide derivatives as CRF-1 receptor antagonists and uses thereof NOVARTIS AG 2011-08-03 CN disclosed
US-20110152261-A1 Organic compounds NOVARTIS AG (CH) 2011-06-23 US disclosed
EP-2323970-A1 CYCLOHEXYL AMIDE DERIVATIVES AND THEIR USE AS CRF-1 RECEPTOR ANTAGONISTS Novartis AG (CH) 2011-05-25 EP disclosed
US-20100273841-A1 AMINE-DERIVATIVES HAVING NPY Y5 RECEPTOR ANTAGONISTIC ACTIVITY AND THE USES THEREOF SHIONOGI & CO., LTD. (JP) 2010-10-28 US disclosed
WO-2010112537-A1 COMPOSITION CONTAINING A SURFACE-DEACTIVATED POLYISOCYANATE AND CURING IN TWO STAGES SIKA TECHNOLOGY AG (CH) 2010-10-07 WO disclosed
US-20100063027-A1 Amine Derivative Having NPY Y5 Receptor Antagonistic Activity SHIONOGI & CO., LTD. (JP) 2010-03-11 US disclosed
WO-2010015655-A1 CYCLOHEXYL AMIDE DERIVATIVES AND THEIR USE AS CRF-1 RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2010-02-11 WO disclosed
US-20100035898-A1 Organic compounds NOVARTIS AG (CH) 2010-02-11 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 (7 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-20190077764-A1 BENZAZEPINE DICARBOXAMIDE COMPOUNDS WITH SECONDARY AMIDE FUNCTION TLR1, TLR5, TLR4 CARM1 196/4885PRMT6 2301/4885CRHR1 1435/4885
US-20100035898-A1 Organic compounds CRH, CRHR1, CRHR2 CARM1 2032/4885PRMT6 2939/4885CRHR1 2/4885
US-20100063027-A1 Amine Derivative Having NPY Y5 Receptor Antagonistic Activity NPY5R, NPY1R, NPY2R CARM1 1637/4885PRMT6 1967/4885CRHR1 21/4885
US-10544102-B2 Benzazepine dicarboxamide compounds with secondary amide function TLR1, TLR5, TLR4 CARM1 196/4885PRMT6 2301/4885CRHR1 1435/4885
US-20100273841-A1 AMINE-DERIVATIVES HAVING NPY Y5 RECEPTOR ANTAGONISTIC ACTIVITY AND THE USES THEREOF NPY5R, NPY1R, NPY2R CARM1 1678/4885PRMT6 1202/4885CRHR1 57/4885
US-20110152261-A1 Organic compounds CRH, CRHR1, CRHR2 CARM1 2190/4885PRMT6 3405/4885CRHR1 2/4885
US-20140088105-A1 Cyclohexyl Amide Derivatives and Their Use as CRF-1 Receptor Antagonists CRHR1, CRH, CRHR2 CARM1 1729/4885PRMT6 2668/4885CRHR1 1/4885

“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.