SCHEMBL4448358

SCHEMBL4448358

NCCCc1ccsc1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL23897421 0.93 TAAR1 (0.72)
SCHEMBL16151249 0.87 TAAR1 (0.58)
SCHEMBL265338 0.86
SCHEMBL9855401 0.85 TAAR1 (0.65)
Hydrochloric Acid SCHEMBL289498 0.84
SCHEMBL10521145 0.83 TAAR1 (0.62)
SCHEMBL19824769 0.82
SCHEMBL8671494 0.80 TAAR1 (0.71)
SCHEMBL5877900 0.78 CYP17A1 (0.50)
SCHEMBL2009601 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118647270-A Novel derivatives of non-coding amino acids and their use as herbicides 福提费斯特有限公司 2024-09-13 CN claimed
WO-2023131951-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD. (IL) 2023-07-13 WO claimed
EP-3658550-A1 NEW PROPANAMINE DERIVATIVES FOR TREATING PAIN AND PAIN RELATED CONDITIONS ESTEVE PHARMACEUTICALS, S.A. (ES) 2020-06-03 EP claimed
WO-2019020792-A1 NEW PROPANAMINE DERIVATIVES FOR TREATING PAIN AND PAIN RELATED CONDITIONS ESTEVE PHARMACEUTICALS, S.A. (ES) 2019-01-31 WO claimed
CN-103588961-B A kind of preparation method of the polythiofuran derivative conducting polymer composite of uV curable 江南大学 2016-06-22 CN claimed
CN-118647270-A Novel derivatives of non-coding amino acids and their use as herbicides 福提费斯特有限公司 2024-09-13 CN disclosed
US-20240284907-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD. (IL) 2024-08-29 US disclosed
WO-2023131951-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD. (IL) 2023-07-13 WO disclosed
EP-3838900-A1 3-ARYLOXY-3-ARYL-PROPYLAMINE COMPOUND AND USES THEREOF Zhangzhou Pien Tze Huang Pharmaceutical Co., Ltd (CN) 2021-06-23 EP disclosed
EP-3658550-A1 NEW PROPANAMINE DERIVATIVES FOR TREATING PAIN AND PAIN RELATED CONDITIONS ESTEVE PHARMACEUTICALS, S.A. (ES) 2020-06-03 EP disclosed
EP-3317271-B1 INHIBITORS OF EZH2 (ENHANCER OF ZESTE HOMOLOG 2) GLAXOSMITHKLINE IP NO 2 LTD (GB) 2020-05-13 EP disclosed
WO-2019020792-A1 NEW PROPANAMINE DERIVATIVES FOR TREATING PAIN AND PAIN RELATED CONDITIONS ESTEVE PHARMACEUTICALS, S.A. (ES) 2019-01-31 WO disclosed
CN-1019113-B Process for preparing 3-arylhydrido-3-substituted propanamines LILLY CO ELI (US) 1992-11-18 CN disclosed
US-4933325-A ANALGESICS, HYPOTENSIVE AGENTS G. D. SEARLE & CO. (US) 1990-06-12 US disclosed
US-4880829-A ANALGESICS, HYPOTENSIVE AGENTS G. D. SEARLE AND COMPANY (US) 1989-11-14 US disclosed
US-4847241-A ANALGESICS G. D. SEARLE & CO. (US) 1989-07-11 US disclosed
US-4822775-A ANALGESICS G. D. SEARLE & CO. (US) 1989-04-18 US disclosed
US-4758675-A 3-thiophene-substituted tyrosyl dipeptide amides G. D. SEARLE & CO. (US) 1988-07-19 US disclosed
CN-87108175-A The propylamine that 3-aryloxy-3-replaces 1988-07-06 CN disclosed
EP-0215297-A2 Substituted dipeptide amides G.D. Searle & Co. (US) 1987-03-25 EP disclosed