SCHEMBL702777

SCHEMBL702777

C=C(C)N1C=NCC1

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
Hydrochloric Acid SCHEMBL2730090 0.98
SCHEMBL9215113 0.76
SCHEMBL11031988 0.73
SCHEMBL5144970 0.71
SCHEMBL9178658 0.71
SCHEMBL361187 0.68
SCHEMBL10888988 0.67
SCHEMBL16720758 0.67
SCHEMBL9215118 0.65
SCHEMBL11791853 0.64 DPP4 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12343418-B2 Hair cosmetic KAO CORPORATION (JP) 2025-07-01 US claimed
CN-116731253-A Insulating material and preparation method and application thereof 清华大学 2023-09-12 CN claimed
US-20220280404-A1 HAIR COSMETIC KAO CORPORATION (JP) 2022-09-08 US claimed
EP-2051688-B1 HAIR TREATMENT COMPOSITION UNILEVER PLC (GB) 2011-01-26 EP claimed
US-20100221206-A1 HAIR TREATMENT COMPOSITION CONOPCO, INC. D/B/A UNILEVER 2010-09-02 US claimed
EP-2051688-A1 HAIR TREATMENT COMPOSITION Unilever PLC (GB) 2009-04-29 EP claimed
WO-2008019917-A1 HAIR TREATMENT COMPOSITION UNILEVER PLC (GB) 2008-02-21 WO claimed
EP-1000610-B1 Polymers for cosmetic formulations BASF AG (DE) 2004-04-07 EP claimed
US-20030091602-A1 METHOD OF TREATING A COSMETIC COMPOSITION BY IRRADIATION WITH NIR RADIATION, AND ITS USE BASF AKTIENGESELLSCHAFT (DE) 2003-05-15 US claimed
US-6380338-B1 POLY(THIO)UREAS; HAIR SETTING COMPOUND BASF AKTIENGESELLSCHAFT (DE) 2002-04-30 US claimed
EP-0491869-B1 CONDITIONING HAIR RELAXER SYSTEM JOHNSON PRODUCTS CO (US) 1995-07-19 EP claimed
EP-0491869-A4 CONDITIONING HAIR RELAXER SYSTEM 1992-07-15 EP claimed
EP-0491869-A1 CONDITIONING HAIR RELAXER SYSTEM. JOHNSON PRODUCTS CO (US) 1992-07-01 EP claimed
US-5077042-A Water sobule organic salt and cationic conditioner JOHNSON PRODUCTS CO., INC. (US) 1991-12-31 US claimed
WO-1991004007-A1 CONDITIONING HAIR RELAXER SYSTEM JOHNSON PRODUCTS CO., INC. (US) 1991-04-04 WO claimed
US-12343418-B2 Hair cosmetic KAO CORPORATION (JP) 2025-07-01 US disclosed
CN-116731253-A Insulating material and preparation method and application thereof 清华大学 2023-09-12 CN disclosed
US-5609168-A AMPHOTERIC SURFACTANT, CATIONIC SURFACTANT-FREE WELLA AKTIENGESELLSCHAFT (DE) 1997-03-11 US disclosed
EP-0685219-A2 Hair treatment agent and process for its use Wella Aktiengesellschaft (DE) 1995-12-06 EP disclosed
US-4668508-A Composition for the hair, containing at least one cationic polymer, one anionic polymer, one sugar and one salt L'OREAL (FR) 1987-05-26 US disclosed