SCHEMBL2400927

SCHEMBL2400927

CN1CCC[C@H]1CCNS(=O)(=O)c1ccc2c(c1)CN(CC1CCCCC1)CC2

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.46
HTR7 P34969 5/20 0.43
TSHR P16473 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MOGAT2 Q3SYC2 4/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL1241268 1.00 HRH3 (0.46) HRH3HTR7TSHRALDH1A1MOGAT2
Water SCHEMBL16161850 0.99 HRH3 (0.46) HRH3HTR7TSHRALDH1A1MOGAT2
Oxalic Acid SCHEMBL1241171 0.96 HRH3 (0.44) HRH3HTR7TSHRALDH1A1MOGAT2
SCHEMBL5630601 0.96 HTR7 (0.45) HRH3HTR7TSHRALDH1A1TP53
Fumaric Acid SCHEMBL9898674 0.93 TSHR (0.41) HRH3HTR7TSHRALDH1A1MOGAT2
Fumaric Acid SCHEMBL9898673 0.93 TSHR (0.41) HRH3HTR7TSHRALDH1A1MOGAT2
Fumaric Acid SCHEMBL27987046 0.93 TSHR (0.41) HRH3HTR7TSHRALDH1A1MOGAT2
Fumaric Acid SCHEMBL9898162 0.93 TSHR (0.41) HRH3HTR7TSHRALDH1A1MOGAT2
Fumaric Acid SCHEMBL2435679 0.93 TSHR (0.41) HRH3HTR7TSHRALDH1A1MOGAT2
Fumaric Acid SCHEMBL2435682 0.93 TSHR (0.41) HRH3HTR7TSHRALDH1A1MOGAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9789102-B2 H3 receptor antagonist for use in the treatment of alzheimer's disease SANOFI (FR) 2017-10-17 US claimed
EP-2833887-B1 AN H3 RECEPTOR ANTAGONIST FOR USE IN THE TREATMENT OF ALZHEIMER'S DISEASE SANOFI SA (FR) 2016-12-28 EP claimed
US-20160256449-A1 H3 RECEPTOR ANTAGONIST FOR USE IN THE TREATMENT OF ALZHEIMER'S DISEASE SANOFI (FR) 2016-09-08 US claimed
EP-3043799-A1 AN H3 RECEPTOR ANTAGONIST COMBINED WITH A CHOLINESTERASE INHIBITOR FOR USE IN THE TREATMENT OF ALZHEIMER'S DISEASE SANOFI (FR) 2016-07-20 EP claimed
EP-2445899-B1 NOVEL FUMARATE SALTS OF A HISTAMINE H3 RECEPTOR ANTAGONIST SANOFI SA (FR) 2016-05-11 EP claimed
US-20160101099-A1 H3 RECEPTOR ANTAGONIST FOR USE IN THE TREATMENT OF ALZHEIMER'S DISEASE SANOFI (FR) 2016-04-14 US claimed
WO-2015032966-A1 AN H3 RECEPTOR ANTAGONIST COMBINED WITH A CHOLINESTERASE INHIBITOR FOR USE IN THE TREATMENT OF ALZHEIMER'S DISEASE SANOFI (FR) 2015-03-12 WO claimed
CN-104363911-A H3 receptor antagonist for treating Alzheimer disease SANOFI SA 2015-02-18 CN claimed
EP-2833887-A1 AN H3 RECEPTOR ANTAGONIST FOR USE IN THE TREATMENT OF ALZHEIMER'S DISEASE SANOFI (FR) 2015-02-11 EP claimed
US-20150031893-A1 AN H3 RECEPTOR ANTAGONIST FOR USE IN THE TREATMENT OF ALZHEIMER'S DISEASE SANOFI SA (FR) 2015-01-29 US claimed
EP-2647377-A1 Use of an h3 receptor antagonist for the treatment of alzheimer's disease SANOFI (FR) 2013-10-09 EP claimed
CN-103221394-A Process for the preparation of 2-(cyclohexylmethyl)-n-{2- [(2s)-1-methylpyrrolidin-2-yl]ethyl}-1, 2, 3, 4- tetrahydroisoquinoline-7-sulfonamide SAI NUOFEI 2013-07-24 CN claimed
US-20130137718-A1 PROCESS FOR THE PREPARATION OF 2-(CYCLOHEXYLMETHYL)-N--1,2,3,4-TETRAHYDROISOQUINOLINE-7-SULFONAMIDE SANOFI (FR) 2013-05-30 US claimed
US-20130123302-A1 PROCESS FOR THE PREPARATION OF 2-(CYCLOHEXYLMETHYL)-N--1,2,3,4-TETRAHYDROISOQUINOLINE-7-SULFONAMIDE SANOFI (FR) 2013-05-16 US claimed
CN-103068815-A Process for the preparation of 2-(cyclohexylmethyl)-n-{2- [(2s)-1-methylpyrrolidin-2-yl]ethyl}-1, 2, 3, 4- tetrahydroisoquinoline-7-sulfonamide SANOFI SA 2013-04-24 CN claimed
EP-2556064-A2 PROCESS FOR THE PREPARATION OF 2-(CYCLOHEXYLMETHYL)-N-{2- [(2S)-1-METHYLPYRROLIDIN-2-YL]ETHYL}-1, 2, 3, 4- TETRAHYDROISOQUINOLINE-7-SULFONAMIDE SANOFI (FR) 2013-02-13 EP claimed
EP-2542530-A2 PROCESS FOR THE PREPARATION OF 2-(CYCLOHEXYLMETHYL)-N-{2- [(2S)-1-METHYLPYRROLIDIN-2-YL]ETHYL}-1, 2, 3, 4- TETRAHYDROISOQUINOLINE-7-SULFONAMIDE SANOFI (FR) 2013-01-09 EP claimed
US-20120149728-A1 NOVEL FUMARATE SALTS OF A HISTAMINE H3 RECEPTOR ANTAGONIST SANOFI (FR) 2012-06-14 US claimed
WO-2011109680-A2 PROCESS FOR THE PREPARATION OF 2-(CYCLOHEXYLMETHYL)-N-{2- [(2S)-1-METHYLPYRROLIDIN-2-YL]ETHYL}-1, 2, 3, 4- TETRAHYDROISOQUINOLINE-7-SULFONAMIDE SANOFI (FR) 2011-09-09 WO claimed
WO-2011109675-A2 PROCESS FOR THE PREPARATION OF 2-(CYCLOHEXYLMETHYL)-N-{2- [(2S)-1-METHYLPYRROLIDIN-2-YL]ETHYL}-1, 2, 3, 4- TETRAHYDROISOQUINOLINE-7-SULFONAMIDE SANOFI (FR) 2011-09-09 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-20160101099-A1 H3 RECEPTOR ANTAGONIST FOR USE IN THE TREATMENT OF ALZHEIMER'S DISEASE HRH3, HRH4, HRH1 HRH3 1/4885HTR7 26/4885TSHR 270/4885
US-20160256449-A1 H3 RECEPTOR ANTAGONIST FOR USE IN THE TREATMENT OF ALZHEIMER'S DISEASE HRH3, HRH4, H1-2 HRH3 1/4885HTR7 41/4885TSHR 435/4885
US-20120149728-A1 NOVEL FUMARATE SALTS OF A HISTAMINE H3 RECEPTOR ANTAGONIST HRH4, HRH3, HRH2 HRH3 2/4885HTR7 43/4885TSHR 716/4885
US-20130137718-A1 PROCESS FOR THE PREPARATION OF 2-(CYCLOHEXYLMETHYL)-N--1,2,3,4-TETRAHYDROISOQUINOLINE-7-SULFONAMIDE SULT1E1, SULT2A1, STS HRH3 2039/4885HTR7 228/4885TSHR 3886/4885
US-20150031893-A1 AN H3 RECEPTOR ANTAGONIST FOR USE IN THE TREATMENT OF ALZHEIMER'S DISEASE HRH3, HRH4, H1-2 HRH3 1/4885HTR7 26/4885TSHR 319/4885
US-20130123302-A1 PROCESS FOR THE PREPARATION OF 2-(CYCLOHEXYLMETHYL)-N--1,2,3,4-TETRAHYDROISOQUINOLINE-7-SULFONAMIDE SULT1E1, SULT2A1, STS HRH3 2039/4885HTR7 228/4885TSHR 3886/4885

“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.