SCHEMBL7701922

SCHEMBL7701922

Cc1ccccc1OC1CCCC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 0.49
SLC6A3 Q01959 8/20 0.49
SLC6A4 P31645 7/20 0.49
KMT2A Q03164 2/20 0.46
SCD O00767 1/20 0.45
CARM1 Q86X55 1/20 0.44
PRMT1 Q99873 1/20 0.44
EPHX2 P34913 1/20 0.44
HTR7 P34969 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GLA P06280 1/20 0.43
HPGD P15428 1/20 0.43
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43

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
SCHEMBL10525480 0.98 SLC6A2 (0.47) SLC6A2SLC6A3SLC6A4KMT2ASCD
SCHEMBL13696497 0.96 SLC6A2 (0.49) SLC6A2SLC6A3SLC6A4KMT2ASCD
SCHEMBL10035281 0.91 SLC6A2 (0.51) SLC6A2SLC6A3SLC6A4SCDEPHX2
SCHEMBL5344402 0.84 MCHR1 (0.49) SLC6A2SLC6A3SLC6A4CARM1PRMT1
SCHEMBL12180578 0.82 KAT2B (0.56) SLC6A2SLC6A3SLC6A4SCDEPHX2
SCHEMBL2088693 0.82 SLC6A2 (0.45) SLC6A2SLC6A3SLC6A4KMT2ASCD
SCHEMBL1229562 0.82 HRH1 (0.62) SLC6A2SLC6A3SLC6A4
SCHEMBL11586746 0.82 MCHR1 (0.46) SLC6A2SLC6A3SLC6A4KMT2ACARM1
SCHEMBL2242864 0.82 MCHR1 (0.51) SLC6A2SLC6A3SLC6A4CARM1PRMT1
Hydrochloric Acid SCHEMBL3467493 0.81 HRH1 (0.60) SLC6A2SLC6A3SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11701370-B2 Phosphonium ion channel blockers and methods for use Nocion Therapeutics, Inc. (US) 2023-07-18 US disclosed
US-20230192613-A1 Charged Ion Channel Blockers and Methods for Use NOCION THERAPEUTICS INC (US) 2023-06-22 US disclosed
US-20230192613-A1 Charged Ion Channel Blockers and Methods for Use NOCION THERAPEUTICS INC (US) 2023-06-22 US disclosed
US-20210128589-A1 PHOSPHONIUM ION CHANNEL BLOCKERS AND METHODS FOR USE Nocion Therapeutics, Inc. 2021-05-06 US disclosed
WO-2019149965-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PAIN UNIVERSITE DE STRASBOURG (FR) 2019-08-08 WO disclosed
EP-2794611-B1 PYRAZOLO[1,5-A]PYRIMIDINES AS ANTIVIRAL AGENTS GILEAD SCIENCES INC (US) 2017-10-11 EP disclosed
US-20170114040-A1 SUBSTITUTED TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS PFIZER LIMITED (GB) 2017-04-27 US disclosed
US-9493438-B2 4,4-difluoro-piperidine-compounds ROTTAPHARM S.R.L. (IT) 2016-11-15 US disclosed
US-20160235748-A1 PYRAZOLO[1,5-A]PYRIMIDINES AS ANTIVIRAL AGENTS GILEAD SCIENCES, INC. 2016-08-18 US disclosed
US-9394278-B2 Substituted triazole derivatives as oxytocin antagonists IXCHELSIS LIMITED (GB) 2016-07-19 US disclosed
US-20110207737-A1 SUBSTITUTED BICYCLIC AMINES FOR THE TREATMENT OF DIABETES MERCK SHARP & DOHME CORP 2011-08-25 US disclosed
WO-2010056717-A1 SUBSTITUTED BICYCLIC AMINES FOR THE TREATMENT OF DIABETES MERCK SHARP & DOHME CORP. (US) 2010-05-20 WO disclosed
US-20090234117-A1 Pyrazolopyrimidine Derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-09-17 US disclosed
US-20090234117-A1 Pyrazolopyrimidine Derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-09-17 US disclosed
US-7547702-B2 4-amino-quinazolines ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2009-06-16 US disclosed
US-7547702-B2 4-amino-quinazolines ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2009-06-16 US disclosed
EP-1903045-A1 PYRAZOLOPYRIMIDINE DERIVATIVE Mitsubishi Tanabe Pharma Corporation (JP) 2008-03-26 EP disclosed
US-20070219216-A1 1-Alkylpiperazinyl-Pyrrolidin-2,5-Dione Derivatives as Adrenergic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2007-09-20 US disclosed
US-20070219216-A1 1-Alkylpiperazinyl-Pyrrolidin-2,5-Dione Derivatives as Adrenergic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2007-09-20 US disclosed
EP-1193261-A1 New thiadiazoles and their use as phosphodiesterase-7 inhibitors WARNER-LAMBERT COMPANY (US) 2002-04-03 EP 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 (8 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-20110207737-A1 SUBSTITUTED BICYCLIC AMINES FOR THE TREATMENT OF DIABETES SSTR5, TAAR5, MC5R SLC6A2 137/4885SLC6A3 280/4885SLC6A4 176/4885
US-20090234117-A1 Pyrazolopyrimidine Derivative MC2R, CRHR1, AVPR2 SLC6A2 151/4885SLC6A3 226/4885SLC6A4 132/4885
US-20070219216-A1 1-Alkylpiperazinyl-Pyrrolidin-2,5-Dione Derivatives as Adrenergic Receptor Antagonists ADRA1D, ADRA1A, ADRB1 SLC6A2 763/4885SLC6A3 1083/4885SLC6A4 2086/4885
US-20170114040-A1 SUBSTITUTED TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS OXTR, AVPR1B, GNRHR SLC6A2 570/4885SLC6A3 198/4885SLC6A4 679/4885
US-20210128589-A1 PHOSPHONIUM ION CHANNEL BLOCKERS AND METHODS FOR USE TRPV1, TRPV5, TRPA1 SLC6A2 555/4885SLC6A3 1380/4885SLC6A4 620/4885
US-20230192613-A1 Charged Ion Channel Blockers and Methods for Use TRPV1, TRPV2, TRPV5 SLC6A2 415/4885SLC6A3 911/4885SLC6A4 642/4885
US-11701370-B2 Phosphonium ion channel blockers and methods for use TRPV1, TRPV5, TRPA1 SLC6A2 555/4885SLC6A3 1380/4885SLC6A4 620/4885
US-20160235748-A1 PYRAZOLO[1,5-A]PYRIMIDINES AS ANTIVIRAL AGENTS TYMP, ZC3HAV1, TYMS SLC6A2 4351/4885SLC6A3 3440/4885SLC6A4 2636/4885

“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.