SCHEMBL944236

SCHEMBL944236

NCC1(O)CCCC1

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
SCHEMBL56742 0.97 — —
Hydrochloric Acid SCHEMBL3198552 0.97 — —
SCHEMBL491716 0.97 TSHR (0.41) —
SCHEMBL17288070 0.97 TSHR (0.41) —
SCHEMBL3043105 0.97 TSHR (0.41) —
SCHEMBL30087352 0.97 TSHR (0.41) —
Hydrochloric Acid SCHEMBL12483735 0.94 USP2 (0.39) —
Hydrochloric Acid SCHEMBL8788527 0.94 USP2 (0.39) —
Hydrochloric Acid SCHEMBL491971 0.94 USP2 (0.39) —
Hydrochloric Acid SCHEMBL57599 0.94 USP2 (0.39) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12435280-B2 Crude oil demulsifier compositions and uses thereof ECOLAB USA INC. (US) 2025-10-07 — — US claimed
EP-4381038-A1 SUGAR/GLUCONOAMIDE ALKOXYLATE COMPOSITIONS AND USES THEREOF Ecolab USA Inc. (US) 2024-06-12 — — EP claimed
EP-4326837-A1 ASPHALTENE AND PARAFFIN DISPERSANT COMPOSITIONS AND USES THEREOF ECOLAB USA INC. (US) 2024-02-28 — — EP claimed
WO-2023014952-A1 SUGAR/GLUCONOAMIDE ALKOXYLATE COMPOSITIONS AND USES THEREOF ECOLAB USA INC. (US) 2023-02-09 — — WO claimed
US-20220364000-A1 CRUDE OIL DEMULSIFIER COMPOSITIONS AND USES THEREOF ECOLAB USA INC. (US) 2022-11-17 — — US claimed
US-20220364002-A1 ASPHALTENE AND PARAFFIN DISPERSANT COMPOSITIONS AND USES THEREOF ECOLAB USA INC. (US) 2022-11-17 — — US claimed
WO-2022225842-A1 ASPHALTENE AND PARAFFIN DISPERSANT COMPOSITIONS AND USES THEREOF ECOLAB USA INC. (US) 2022-10-27 — — WO claimed
US-9932335-B2 Pyrrolopyridine or pyrazolopyridine derivatives HOFFMANN-LA ROCHE INC. (US) 2018-04-03 — — US claimed
EP-2928867-B1 PYRIDINE-2-AMIDES USEFUL AS CB2 AGONISTS HOFFMANN LA ROCHE (CH) 2017-08-09 — — EP claimed
CN-104854087-B Indole carboxamide derivatives as P2X receptor antagonists 埃科特莱茵药品有限公司 2017-03-22 — — CN claimed
US-9556117-B2 Indole carboxamide derivatives as P2X7 receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2017-01-31 — — US claimed
EP-2935211-B1 INDOLE CARBOXAMIDE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2016-11-09 — — EP claimed
US-9409866-B2 Pyridine-2-amides useful as CB2 agonists HOFFMANN-LA ROCHE INC. (US) 2016-08-09 — — US claimed
US-20160194321-A1 PYRROLOPYRIDINE OR PYRAZOLOPYRIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2016-07-07 — — US claimed
US-20150344429-A1 PYRIDINE-2-AMIDES USEFUL AS CB2 AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2015-12-03 — — US claimed
US-20150344425-A1 INDOLE CARBOXAMIDE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2015-12-03 — — US claimed
US-20120190680-A1 Heteroaryl Amide Analogues H. LUNDBECK A/S (DK) 2012-07-26 — — US claimed
US-20260015553-A1 SUGAR/GLUCONOAMIDE ALKOXYLATE COMPOSITIONS AND USES THEREOF ECOLAB USA INC (US) 2026-01-15 — — US disclosed
WO-2005076783-A2 SULFONE SUBSTITUTED IMIDAZO RING ETHERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-08-25 — — WO disclosed
US-4017539-A Biguanide compounds and anti-diabetic compositions BOEHRINGER MANNHEIM G.M.B.H. (DT) 1977-04-12 — — US disclosed
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