SCHEMBL1262658

SCHEMBL1262658

CCCCCCCCCCCCN1CCCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 2/20 0.75
▸ GNAI3 P08754 6/20 0.59
▸ GNAO1 P09471 6/20 0.59
▸ GNAI1 P63096 6/20 0.59
▸ LTA4H P09960 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.47
▸ BCHE P06276 1/20 0.47

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
SCHEMBL634336 1.00 HRH3 (0.75) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL11226591 1.00 HRH3 (0.75) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL1262669 1.00 HRH3 (0.75) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL11210977 1.00 HRH3 (0.75) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL9641523 1.00 HRH3 (0.75) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL23682856 1.00 HRH3 (0.75) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL1260762 1.00 HRH3 (0.75) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL1277091 1.00 HRH3 (0.75) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL22151380 1.00 HRH3 (0.75) HRH3GNAI3GNAO1GNAI1LTA4H
SCHEMBL11224880 1.00 HRH3 (0.75) HRH3GNAI3GNAO1GNAI1LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104073910-B Application of the ionic liquid in polyethylene terephthalate composite fibre 浙江佳华精化股份有限公司 2017-06-20 — — CN claimed
CN-104073900-B Application of ionic liquid to polyurethane complex fiber 杭州师范大学 2017-05-10 — — CN claimed
CN-105413397-A Compound absorbent for removing CO2 from tail gas SINOPEC ENERGY ENV PROT ENG SCIENCE & TECH CO LTD 2016-03-23 — — CN claimed
US-RE39033-E1 Potentiation of the microbicide 2-(thiocyanomethylthio)benzothiazole using an N-alkyl heterocyclic compound BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 2006-03-21 — — US claimed
EP-1575617-A1 USE OF TOPICAL PHARMACEUTICAL COMPOSITIONS COMPRISING AN ACTIVE AGENT AND PERMEATION-ENHANCING BASE FOR THE MANUFACTURE OF A MEDICAMENT TO TREAT VARIOUS FORMS OF INFLAMMATORY DERMATOSIS Dermatrends, Inc. (US) 2005-09-21 — — EP claimed
EP-1558228-A1 TOPICAL ADMINISTRATION OF BASIC ANTIFUNGAL COMPOSITIONS TO TREAT FUNGAL INFECTIONS OF THE NAILS Dermatrends, Inc. (US) 2005-08-03 — — EP claimed
EP-1556008-A1 USE OF BASES FOR THE MANUFACTURE OF A MEDICAMENT IN THE TREATMENT OF DIFFERENT FORMS OF INFLAMMATORY DERMATOSIS Dermatrends, Inc. (US) 2005-07-27 — — EP claimed
EP-1429791-A4 METHOD AND TOPICAL FORMULATION FOR TREATING SKIN CONDITIONS ASSOCIATED WITH AGING DERMATRENDS INC (US) 2005-01-05 — — EP claimed
US-6821523-B2 APPLYING BASIC DRUGS TO SKINS FOR PROPHYLAXIS OF HUMAN PAPILLOMAVIRUS INFECTIONS; SKIN DISODERS DERMATRENDS, INC. 2004-11-23 — — US claimed
EP-1429791-A2 METHOD AND TOPICAL FORMULATION FOR TREATING SKIN CONDITIONS ASSOCIATED WITH AGING Dermatrends, Inc. (US) 2004-06-23 — — EP claimed
WO-1998006265-A2 TREATMENT OF FUNGAL INFECTIONS USING A COMBINATION OF AN ANTI-FUNGAL COMPOUND AND AN N-ALKYL-HETEROCYCLIC COMPOUND, ESPECIALLY N-DODECYL-MORPHOLINE BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1998-02-19 — — WO claimed
US-5693631-A SYNERGISTIC BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1997-12-02 — — US claimed
EP-0697813-B1 N-DODECYL HETEROCYCLIC COMPOUNDS USEFUL AS INDUSTRIAL MICROBICIDES AND PRESERVATIVES BUCKMAN LABOR INC (US) 1997-09-17 — — EP claimed
WO-1996038043-A1 POTENTIATION OF BIOCIDE ACTIVITY USING AN N-ALKYL HETEROCYCLIC COMPOUND BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1996-12-05 — — WO claimed
WO-1996038042-A1 POTENTIATION OF THE MICROBICIDE 2-(THIOCYANOMETHYLTHIO)BENZOTHIAZOLE USING AN N-ALKYL HETEROCYCLIC COMPOUND BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1996-12-05 — — WO claimed
EP-0697813-A1 N-DODECYL HETEROCYCLIC COMPOUNDS USEFUL AS INDUSTRIAL MICROBICIDES AND PRESERVATIVES BUCKMAN LABOR INC (US) 1996-02-28 — — EP claimed
WO-1994026112-A1 N-DODECYL HETEROCYCLIC COMPOUNDS USEFUL AS INDUSTRIAL MICROBICIDES AND PRESERVATIVES BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1994-11-24 — — WO claimed
US-5250194-A Slimicides, fungicides; for aqueous systems, cooling water, papermaking, paints BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1993-10-05 — — US claimed
US-4321247-A Process for preparing sodium bicarbonate and hydrogen chloride CHEMISCHE WERKE HULS AG (DE) 1982-03-23 — — US claimed
US-4320106-A Method for preparing sodium bicarbonate and hydrogen chloride CHEMISCHE WERKE HULS AG (DE) 1982-03-16 — — US claimed
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