SCHEMBL7030922

SCHEMBL7030922

[CH2]C(CCCC)C(C)=O

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
SCHEMBL28041948 0.98 CA2 (0.41)
SCHEMBL28041816 0.98 CA2 (0.41)
SCHEMBL28618445 0.91 FAAH (0.49)
SCHEMBL28407044 0.91 FAAH (0.49)
SCHEMBL3227977 0.84
SCHEMBL2309562 0.80
Hydrochloric Acid SCHEMBL28849390 0.78 CA2 (0.52)
SCHEMBL7860768 0.78
SCHEMBL28936088 0.75 CA2 (0.44)
SCHEMBL27617288 0.75 CA2 (0.59)

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002049433-A2 REPELLENT COSMETIC COMPOSITION ACTIVE AGAINST SCHISTOSOME FURCOCERCARIA LABORATOIRES ASEPTA S.A.M. (MC) 2002-06-27 WO claimed
CN-115023138-A Quantitative spray aerosol product for controlling specific harmful substances, and method for controlling specific harmful substances using same 大日本除虫菊株式会社 2022-09-06 CN disclosed
WO-2002049433-A3 REPELLENT COSMETIC COMPOSITION ACTIVE AGAINST SCHISTOSOME FURCOCERCARIA ASEPTA S A M LAB (MC) 2003-01-03 WO disclosed
WO-2002049433-A2 REPELLENT COSMETIC COMPOSITION ACTIVE AGAINST SCHISTOSOME FURCOCERCARIA LABORATOIRES ASEPTA S.A.M. (MC) 2002-06-27 WO disclosed
WO-2002049433-A2 REPELLENT COSMETIC COMPOSITION ACTIVE AGAINST SCHISTOSOME FURCOCERCARIA LABORATOIRES ASEPTA S.A.M. (MC) 2002-06-27 WO disclosed