SCHEMBL1240317

SCHEMBL1240317

C=CCNc1ccc(NCCCCC)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
ABL1 P00519 1/20 0.45
KCNH3 Q9ULD8 2/20 0.43
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
LMNA P02545 2/20 0.39
ACHE P22303 2/20 0.39
CYP1A2 P05177 1/20 0.39
MAOA P21397 1/20 0.39
CNR1 P21554 1/20 0.39
DRD4 P21917 1/20 0.39
HRH2 P25021 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
MAPK1 P28482 1/20 0.39
NTSR1 P30989 1/20 0.39
HRH1 P35367 1/20 0.39

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
SCHEMBL9512936 0.98 ABL1 (0.47) CA12CA1CA2CA9ABL1
SCHEMBL4874435 0.94 CA1 (0.49) CA12CA1CA2CA9ABL1
SCHEMBL1241959 0.84 ABL1 (0.56) ABL1KCNH3LMNAACHECYP1A2
SCHEMBL11565013 0.82 ABL1 (0.43) ABL1KCNH3THRATHRBCYP1A2
SCHEMBL11476522 0.82 ABL1 (0.59) ABL1KCNH3PRSS1MAPTALDH1A1
SCHEMBL2720066 0.82 ABL1 (0.59) ABL1KCNH3PRSS1MAPTALDH1A1
SCHEMBL187892 0.82 ABL1 (0.59) ABL1KCNH3PRSS1MAPTALDH1A1
SCHEMBL11498100 0.82 ABL1 (0.59) ABL1KCNH3PRSS1MAPTALDH1A1
SCHEMBL9506930 0.82 ABL1 (0.59) ABL1KCNH3PRSS1MAPTALDH1A1
SCHEMBL16439908 0.82 ABL1 (0.59) ABL1KCNH3PRSS1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3514200-B1 A METHOD OF DEVULCANIZING A RUBBER VULCANIZATE KARGRO RECYCLING B V (NL) 2020-08-26 EP claimed
EP-3514200-A1 A METHOD OF DEVULCANIZING A RUBBER VULCANIZATE Kargro Recycling B.V. (NL) 2019-07-24 EP claimed
EP-2241592-B1 Rubber compound CONTINENTAL REIFEN DEUTSCHLAND (DE) 2011-10-12 EP claimed
US-7879934-B2 Rubber compositions CHEMTURA CORPORATION (US) 2011-02-01 US claimed
EP-2241592-A1 Rubber compound Continental Reifen Deutschland GmbH (DE) 2010-10-20 EP claimed
US-20090048376-A1 Rubber compositions ADDIVANT USA, LLC 2009-02-19 US claimed
US-20060058461-A1 Method of recycling of commingled plastics waste to tough thermoplastic materials USTAV MAKROMOLEKULARNI CHEMIE AKADEMIE VED CESKE REPUBLIKY (CZ) 2006-03-16 US claimed
WO-2004039875-A1 METHOD OF RECYCLING OF COMMINGLED PLASTICS WASTE TO TOUGH THERMOPLASTIC MATERIALS Ústav Makromolekulární Chemie Akademie Ved Ceské Republiky (CZ) 2004-05-13 WO claimed
EP-0908505-B1 Method for operating an ethylene production plant comprising the addition of an anti-aging additive composition to a quench oil. CHIMEC SPA (IT) 2004-04-28 EP claimed
WO-2004018569-A1 METHOD FOR PRODUCING ADDITIVE CARBON BLACK COLUMBIAN CHEMICALS COMPANY (US) 2004-03-04 WO claimed
US-20020165302-A1 Mixing an amine antidegradant with carbon black, free of a solvent or carrier; improving dispersion, viscosity when mixing with rubber, time reduction, cost savings and reduces environmental impact COLUMBIAN CHEMICALS COMPANY 2002-11-07 US claimed
US-6096188-A SELECTED FROM THE GROUP CONSISTING OF ALKYLATED PHENOLS, ALKYLATED BIPHENOLS, DIPHENOLS, ALKYLATED DIPHENOLS, AROMATIC AMINES AND NITROXIDES, PRECURSORS AND MIXTURES THEREOF, SELECTED ACCORDINGLY TO THE MEASURED VALUE OF SAID QUENCH OIL CHIMEC S.P.A. (IT) 2000-08-01 US claimed
EP-0908505-A1 Anti-aging additive composition for a quench oil circuit in an ethylene production plant and method for operating the circuit CHIMEC S.P.A. (IT) 1999-04-14 EP claimed
US-4764547-A WITH AMINE OR QUINOLINE COMPOUND BRIDGESTONE CORPORATION (JP) 1988-08-16 US claimed
WO-2024047583-A1 PREPARATION OF SILANE-GRAFTED EPDM AND MOISTURE CURING THEREOF AIRBOSS OF AMERICA CORP. (CA) 2024-03-07 WO disclosed
US-11639433-B2 Method for fabricating a rubber-based elastomeric glove/material HONEYWELL INTERNATIONAL INC. (US) 2023-05-02 US disclosed
US-20200369854-A1 RUBBER COMPOSITION AND HOSE THE YOKOHAMA RUBBER CO., LTD. (JP) 2020-11-26 US disclosed
US-4133780-A Polyurethane foams prepared from condensation products of amines, epihalohydrins and alkylene oxides BASF WYANDOTTE CORPORATION (US) 1979-01-09 US disclosed
US-3936536-A CARBON BLACK, COBALT DIAMMINE DICHLORIDE, ZINC THE FIRESTONE TIRE & RUBBER COMPANY (US) 1976-02-03 US disclosed
US-3933739-A N-Isopropyl-N'-5-methyl-3-heptyl-p-phenylenediamine antiozonant for rubber MONSANTO COMPANY (US) 1976-01-20 US disclosed