SCHEMBL55980

SCHEMBL55980

CC[CH]C(C)CCCC

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
SCHEMBL3891492 0.92 OPRM1 (0.46)
SCHEMBL12483541 0.90 OPRM1 (0.44)
SCHEMBL12484810 0.90 OPRM1 (0.44)
SCHEMBL3886041 0.90 OPRM1 (0.44)
SCHEMBL11291105 0.90 OPRM1 (0.44)
SCHEMBL57057 0.82
SCHEMBL20605268 0.81 TSHR (0.38)
SCHEMBL56651 0.81 DNM1 (0.36)
SCHEMBL8078549 0.79
SCHEMBL10538421 0.79 DNM1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108658816-B N-aryl amidine substituted trifluoroethyl sulfide derivatives useful as acaricides and insecticides 拜尔农作物科学股份公司 2023-05-02 CN claimed
CN-108184905-B Compositions comprising biological control agents and fungicides 拜尔农作物科学股份公司 2021-12-28 CN claimed
CN-107996613-B Compositions comprising biological control agents and pesticides 拜尔农作物科学股份公司 2021-10-22 CN claimed
CN-109169661-B Compositions comprising biological control agents and insecticides 拜耳作物科学股份公司 2021-09-21 CN claimed
CN-107926985-B Compositions comprising biological control agents and fungicides 拜尔农作物科学股份公司 2021-02-02 CN claimed
CN-106962403-B Compositions comprising biological control agents and pesticides 拜耳作物科学股份公司 2020-05-05 CN claimed
CN-104507317-B Composition comprising a biological control agent and a fungicide, use thereof, kit 拜尔农作物科学股份公司 2019-11-15 CN claimed
CN-104519742-B Compositions comprising biological control agents and pesticides 拜尔农作物科学股份公司 2019-10-25 CN claimed
CN-105722830-B Aryl thioethers derivative and aryl sulfoxid es derivative as acaricide and insecticide 拜耳作物科学股份公司 2019-06-04 CN claimed
CN-109688816-A Active compound combinations and method for protecting plant propagation material 拜耳作物科学股份公司 2019-04-26 CN claimed
CN-103635089-A Active compound combinations comprising a (thio)carboxamide derivative and a fungicidal compound BAYER IP GMBH 2014-03-12 CN claimed
CN-103597077-A Soybean event SYHT0H2 and compositions and methods for detection thereof SYNGENTA PARTICIPATIONS AG 2014-02-19 CN claimed
US-20130324600-A1 INGENOL-3-ACYLATES I LEO LABORATORIES LIMITED (IE) 2013-12-05 US claimed
EP-2655311-A1 INGENOL-3-ACYLATES I LEO LABORATORIES LIMITED (IE) 2013-10-30 EP claimed
CN-103347389-A Pesticidal mixtures with improved properties BAYER IP GMBH 2013-10-09 CN claimed
CN-103153065-A Anthranilamides in combination with fungicides BAYER CROPSCIENCE AG 2013-06-12 CN claimed
CN-102595905-A Synergistic fungicidal combinations containing dithiino-tetracarboxamide fungicides BAYER CROPSCIENCE AG 2012-07-18 CN claimed
CN-102573479-A 3-[1-(3-haloalkyl)-triazolyl]-phenyl-sulfide derivatives for use as acaricides and insecticides BAYER CROPSCIENCE AG 2012-07-11 CN claimed
WO-2012085189-A1 INGENOL-3-ACYLATES I LEO PHARMA A/S (DK) 2012-06-28 WO claimed
CN-102471291-A 3-triazolylphenyl-substituted sulfide derivatives for use as acaricides and insecticides BAYER CROPSCIENCE AG 2012-05-23 CN claimed